1-(3-Aminopropyl)-4-(2-methoxyphenyl)piperazine - CAS 20529-23-1

Catalog:	BB016044
Product Name:	1-(3-Aminopropyl)-4-(2-methoxyphenyl)piperazine
CAS:	20529-23-1
Synonyms:	3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-amine

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Computed Properties

IUPAC Name:	3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-amine
Description:	1-(3-Aminopropyl)-4-(2-methoxyphenyl)piperazine (CAS# 20529-23-1) is a useful research chemical.
Molecular Weight:	249.35
Molecular Formula:	C14H23N3O
Canonical SMILES:	COC1=CC=CC=C1N2CCN(CC2)CCCN
InChI:	InChI=1S/C14H23N3O/c1-18-14-6-3-2-5-13(14)17-11-9-16(10-12-17)8-4-7-15/h2-3,5-6H,4,7-12,15H2,1H3
InChI Key:	OVGGXHMQXIQOBR-UHFFFAOYSA-N
MDL:	MFCD04107512
LogP:	1.86920

Publication Number	Title	Priority Date
CN-111253325-A	Amino quinazoline aryl piperazine compound and pharmaceutical composition and application thereof	20200325
CN-109516960-B	Preparation method of urapidil hydrochloride	20181226
CN-104710358-A	Quinolin-4-carboxamide derivative and medicinal use thereof	20150130
CN-104672135-A	Novel quinoline-4-carboxamide derivative, preparation method thereof, pharmaceutical composition containing novel quinoline-4-carboxamide derivative, and medical application of novel quinoline-4-carboxamide derivative	20141222
CN-103980195-A	Amide-type phenylpiperazine derivative, and salt and application thereof in preparing medicine for treating benign prostatic hyperplasia	20140428

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Related Functional Groups

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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	229
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	249.184112366
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	249.184112366
Rotatable Bond Count:	5
Topological Polar Surface Area:	41.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2