N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride

C12H16Cl2N2O — CID 119382939

IUPACN-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride
SMILESCl.NCCNC(=O)C1(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C12H15ClN2O.ClH/c13-10-3-1-9(2-4-10)12(5-6-12)11(16)15-8-7-14;/h1-4H,5-8,14H2,(H,15,16);1H
InChIKeyPCSDPJFILQZISD-UHFFFAOYSA-N
MW275.18 g/mol
LogP1.87
Rot. Bonds4

About N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride

N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride (PubChem CID 119382939) has the molecular formula C12H16Cl2N2O and a molecular weight of 275.18 g/mol. Its IUPAC name is N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride
PubChem CID119382939
Molecular FormulaC12H16Cl2N2O
Molecular Weight275.18 g/mol
Exact Mass274.06
IUPAC NameN-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride
SMILESCl.NCCNC(=O)C1(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C12H15ClN2O.ClH/c13-10-3-1-9(2-4-10)12(5-6-12)11(16)15-8-7-14;/h1-4H,5-8,14H2,(H,15,16);1H
InChIKeyPCSDPJFILQZISD-UHFFFAOYSA-N
XLogP1.87
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 110464710
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N-(2-amino-2-methylpropyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride
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N-(2-aminoethyl)-1-phenylcyclobutane-1-carboxamide;hydrochloride
CID 119383117
N-[2-(4-aminophenyl)ethyl]-1-(4-chlorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119548194
1-(4-chlorophenyl)-N-[2-(2-hydroxyphenyl)ethyl]cyclopropane-1-carboxamide
CID 69262751
1-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]cyclopropane-1-carboxamide
CID 17460142
1-(4-chlorophenyl)-N-[[1-(hydroxymethyl)cyclopropyl]methyl]cyclopropane-1-carboxamide
CID 80711321
N-but-3-ynyl-1-(4-chlorophenyl)cyclopentane-1-carboxamide
CID 90537906
1-(4-chlorophenyl)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]cyclopropane-1-carboxamide
CID 115362498
1-(4-chlorophenyl)-N-ethylcyclohexane-1-carboxamide
CID 118534759
1-[[[1-(4-chlorophenyl)cyclopropanecarbonyl]amino]methyl]cyclobutane-1-carboxylic acid
CID 81369485

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride (CID 119382939) is N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride is Cl.NCCNC(=O)C1(c2ccc(Cl)cc2)CC1.
What is the InChIKey of N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride?
The InChIKey is PCSDPJFILQZISD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O.ClH/c13-10-3-1-9(2-4-10)12(5-6-12)11(16)15-8-7-14;/h1-4H,5-8,14H2,(H,15,16);1H.
What are the key properties of N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride?
N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride has a molecular weight of 275.18 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119382939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).