N-(3-Iodo-pyridin-4-yl)-2,2-dimethyl-propionamide - CAS 113975-33-0

Name: N-(3-Iodo-pyridin-4-yl)-2,2-dimethyl-propionamide
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB003289
Product Name:	N-(3-Iodo-pyridin-4-yl)-2,2-dimethyl-propionamide
CAS:	113975-33-0
Synonyms:	N-(3-iodopyridin-4-yl)-2,2-dimethylpropanamide

Technical Data

Patents

Computed Properties

IUPAC Name:	N-(3-iodopyridin-4-yl)-2,2-dimethylpropanamide
Description:	N-(3-Iodo-pyridin-4-yl)-2,2-dimethyl-propionamide (CAS# 113975-33-0) is a useful research chemical.
Molecular Weight:	304.13
Molecular Formula:	C10H13IN2O
Canonical SMILES:	CC(C)(C)C(=O)NC1=C(C=NC=C1)I
InChI:	InChI=1S/C10H13IN2O/c1-10(2,3)9(14)13-8-4-5-12-6-7(8)11/h4-6H,1-3H3,(H,12,13,14)
InChI Key:	GPMKCDBJLNTANL-UHFFFAOYSA-N
Boiling Point:	402.6 °C at 760 mmHg
Melting Point:	157.9-158.1 °C
Purity:	95 %
Density:	1.623 g/cm³
Appearance:	Powder
MDL:	MFCD04971323
LogP:	2.74380

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Related Functional Groups

Pyridines

[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[76167-49-2]C11H10N2O
2-(Pyridin-3-yloxy)aniline
[871507-15-2]C23H18N2O2
2-(Pyridin-4-yl)-1-(4-(quinolin-2-ylmethoxy)phenyl)ethan-1-one
[76006-14-9]C6H4ClN3
3-Chloro-1H-pyrazolo[3,4-c]pyridine
[2241983-13-9]C24H26NOD
5-[(8S,9S,13S,14S)-3-Methoxy-13-methyl-7,8,9,11,12,13,14,15-octahydro-6H-cyclopenta[a]phenanthren-17-yl]pyridine-2-D

Publication Number	Title	Priority Date
EP-1456206-A1	Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands	20011220
EP-1456206-B1	Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands	20011220
US-2003171395-A1	Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands	20011220
US-2005020598-A1	Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands	20011220
US-2008114023-A1	Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands	20011220

Complexity:	213
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	304.00726
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	304.00726
Rotatable Bond Count:	2
Topological Polar Surface Area:	42
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1