N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride

C15H24ClN3O — CID 119515073

IUPACN-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride
SMILESCCC(CC1CCCC1)C(=O)Nc1ccc(N)nc1.Cl
InChIInChI=1S/C15H23N3O.ClH/c1-2-12(9-11-5-3-4-6-11)15(19)18-13-7-8-14(16)17-10-13;/h7-8,10-12H,2-6,9H2,1H3,(H2,16,17)(H,18,19);1H
InChIKeyPHCQQQBGLMBZTA-UHFFFAOYSA-N
MW297.83 g/mol
LogP3.63
Rot. Bonds5

About N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride

N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride (PubChem CID 119515073) has the molecular formula C15H24ClN3O and a molecular weight of 297.83 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride
PubChem CID119515073
Molecular FormulaC15H24ClN3O
Molecular Weight297.83 g/mol
Exact Mass297.16
IUPAC NameN-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride
SMILESCCC(CC1CCCC1)C(=O)Nc1ccc(N)nc1.Cl
InChIInChI=1S/C15H23N3O.ClH/c1-2-12(9-11-5-3-4-6-11)15(19)18-13-7-8-14(16)17-10-13;/h7-8,10-12H,2-6,9H2,1H3,(H2,16,17)(H,18,19);1H
InChIKeyPHCQQQBGLMBZTA-UHFFFAOYSA-N
XLogP3.63
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.83
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-amino-3-pyridinyl)-2-cyclopentylacetamide;hydrochloride
CID 119260450
N-(6-amino-3-pyridinyl)-4-cyclopentylbutanamide;hydrochloride
CID 119516594
N-(6-amino-3-pyridinyl)-2-[(2-bromophenyl)methyl]butanamide
CID 119515590
(2S)-N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)propanamide
CID 99776072
N-[4-[5-(aminomethyl)-1H-1,2,4-triazol-3-yl]phenyl]-2-(cyclohexylmethyl)butanamide;hydrochloride
CID 120566266
3-[[4-[2-(cyclopentylmethyl)butanoylamino]benzoyl]amino]propanoic acid
CID 119222956
N-[6-(4-cyclopentylpiperazin-1-yl)-3-pyridinyl]-2-ethylbutanamide
CID 11638768
N-(6-amino-3-pyridinyl)-2-methylpentanamide
CID 62899385
N-[2-(4-aminophenyl)ethyl]-2-(cyclopentylmethyl)butanamide;hydrochloride
CID 119547626
N-(6-amino-3-pyridinyl)-2-cyclopropylacetamide
CID 62901685
N-(6-amino-3-pyridinyl)-2-ethoxypropanamide
CID 119516288
N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide
CID 119515078

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride?
The IUPAC name of N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride (CID 119515073) is N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride?
The canonical SMILES for N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride is CCC(CC1CCCC1)C(=O)Nc1ccc(N)nc1.Cl.
What is the InChIKey of N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride?
The InChIKey is PHCQQQBGLMBZTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O.ClH/c1-2-12(9-11-5-3-4-6-11)15(19)18-13-7-8-14(16)17-10-13;/h7-8,10-12H,2-6,9H2,1H3,(H2,16,17)(H,18,19);1H.
What are the key properties of N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride?
N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride has a molecular weight of 297.83 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride is sourced from PubChem (CID 119515073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).