N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride

C19H23Cl2N3O — CID 19661841

IUPACN-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
SMILESCl.O=C(CCN1CCN(c2ccccc2)CC1)Nc1cccc(Cl)c1
InChIInChI=1S/C19H22ClN3O.ClH/c20-16-5-4-6-17(15-16)21-19(24)9-10-22-11-13-23(14-12-22)18-7-2-1-3-8-18;/h1-8,15H,9-14H2,(H,21,24);1H
InChIKeyMQCXASFQOYTDNT-UHFFFAOYSA-N
MW380.32 g/mol
LogP3.91
Rot. Bonds5

About N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride

N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride (PubChem CID 19661841) has the molecular formula C19H23Cl2N3O and a molecular weight of 380.32 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
PubChem CID19661841
Molecular FormulaC19H23Cl2N3O
Molecular Weight380.32 g/mol
Exact Mass379.12
IUPAC NameN-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
SMILESCl.O=C(CCN1CCN(c2ccccc2)CC1)Nc1cccc(Cl)c1
InChIInChI=1S/C19H22ClN3O.ClH/c20-16-5-4-6-17(15-16)21-19(24)9-10-22-11-13-23(14-12-22)18-7-2-1-3-8-18;/h1-8,15H,9-14H2,(H,21,24);1H
InChIKeyMQCXASFQOYTDNT-UHFFFAOYSA-N
XLogP3.91
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.32
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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3-[4-(4-chlorophenyl)piperazin-1-yl]-N-(3-methylphenyl)propanamide
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N-(4-chloro-2-methylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide
CID 109027177
N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
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N-(2,4-dichlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide
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2-[4-(3-chlorophenyl)piperazin-1-yl]-N-phenylacetamide
CID 6467969
N-(4-methylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
CID 19661863
3-(4-benzoylpiperidin-1-yl)-N-(3-chlorophenyl)propanamide
CID 33215010
N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
CID 109014570
N-(3-chlorophenyl)-3-[4-(2-cyanophenyl)-1,4-diazepan-1-yl]propanamide
CID 60500646
N-[2-(3-chloroanilino)-2-oxoethyl]-4-phenylpiperazine-1-carboxamide
CID 53368887

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride?
The IUPAC name of N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride (CID 19661841) is N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride.
What is the SMILES notation for N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride?
The canonical SMILES for N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride is Cl.O=C(CCN1CCN(c2ccccc2)CC1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride?
The InChIKey is MQCXASFQOYTDNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O.ClH/c20-16-5-4-6-17(15-16)21-19(24)9-10-22-11-13-23(14-12-22)18-7-2-1-3-8-18;/h1-8,15H,9-14H2,(H,21,24);1H.
What are the key properties of N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride?
N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride has a molecular weight of 380.32 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride is sourced from PubChem (CID 19661841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).