N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride

C17H27ClN2O — CID 119604654

IUPACN-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride
SMILESCCC(CC(=O)NC1CCCC1CN)c1ccccc1.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-2-13(14-7-4-3-5-8-14)11-17(20)19-16-10-6-9-15(16)12-18;/h3-5,7-8,13,15-16H,2,6,9-12,18H2,1H3,(H,19,20);1H
InChIKeyKCWSKUPAPIRVDR-UHFFFAOYSA-N
MW310.87 g/mol
LogP3.24
Rot. Bonds6

About N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride

N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride (PubChem CID 119604654) has the molecular formula C17H27ClN2O and a molecular weight of 310.87 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride
PubChem CID119604654
Molecular FormulaC17H27ClN2O
Molecular Weight310.87 g/mol
Exact Mass310.18
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride
SMILESCCC(CC(=O)NC1CCCC1CN)c1ccccc1.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-2-13(14-7-4-3-5-8-14)11-17(20)19-16-10-6-9-15(16)12-18;/h3-5,7-8,13,15-16H,2,6,9-12,18H2,1H3,(H,19,20);1H
InChIKeyKCWSKUPAPIRVDR-UHFFFAOYSA-N
XLogP3.24
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.87
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)cyclohexyl]-4-methyl-3-phenylpentanamide;hydrochloride
CID 119609450
3-amino-N-[2-(aminomethyl)cyclohexyl]-3-phenylpropanamide
CID 122080744
N-[2-(aminomethyl)cyclopentyl]-4,4,4-trifluoro-3-phenylbutanamide;hydrochloride
CID 119602801
N-[2-(aminomethyl)cyclopentyl]-2-(diethylamino)-2-phenylacetamide
CID 119602222
N-[2-(aminomethyl)cyclopentyl]-3-methyl-2-phenylbutanamide;hydrochloride
CID 119601012
4-(3-phenylpentanoylamino)cyclohexane-1-carboxylic acid
CID 119229843
N-[2-(aminomethyl)cyclopentyl]-2-phenoxyacetamide;hydrochloride
CID 119601101
N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride
CID 119602350
N-[2-(aminomethyl)cyclohexyl]-3-(4-ethylphenyl)butanamide
CID 119609944
N-[2-(aminomethyl)cyclopentyl]-2-(2-bromophenyl)acetamide;hydrochloride
CID 119603681
N-[(1S,2R)-2-(aminomethyl)cyclopentyl]benzamide
CID 94903786
N-[2-(aminomethyl)cyclopentyl]-2-(2-propan-2-yloxyphenyl)acetamide;hydrochloride
CID 119601537

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride (CID 119604654) is N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride is CCC(CC(=O)NC1CCCC1CN)c1ccccc1.Cl.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride?
The InChIKey is KCWSKUPAPIRVDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O.ClH/c1-2-13(14-7-4-3-5-8-14)11-17(20)19-16-10-6-9-15(16)12-18;/h3-5,7-8,13,15-16H,2,6,9-12,18H2,1H3,(H,19,20);1H.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride?
N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride has a molecular weight of 310.87 g/mol, XLogP of 3.24, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride is sourced from PubChem (CID 119604654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).