N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride

C12H22ClN3O2 — CID 119604175

IUPACN-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride
SMILESCl.NCC1CCCC1NC(=O)C1CCC(=O)NC1
InChIInChI=1S/C12H21N3O2.ClH/c13-6-8-2-1-3-10(8)15-12(17)9-4-5-11(16)14-7-9;/h8-10H,1-7,13H2,(H,14,16)(H,15,17);1H
InChIKeyBTFUFBYBGUUBPH-UHFFFAOYSA-N
MW275.78 g/mol
LogP0.18
Rot. Bonds3

About N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride

N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride (PubChem CID 119604175) has the molecular formula C12H22ClN3O2 and a molecular weight of 275.78 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride
PubChem CID119604175
Molecular FormulaC12H22ClN3O2
Molecular Weight275.78 g/mol
Exact Mass275.14
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride
SMILESCl.NCC1CCCC1NC(=O)C1CCC(=O)NC1
InChIInChI=1S/C12H21N3O2.ClH/c13-6-8-2-1-3-10(8)15-12(17)9-4-5-11(16)14-7-9;/h8-10H,1-7,13H2,(H,14,16)(H,15,17);1H
InChIKeyBTFUFBYBGUUBPH-UHFFFAOYSA-N
XLogP0.18
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.78
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(aminomethyl)cyclohexyl]-6-oxopiperidine-3-carboxamide;hydrochloride
CID 119611735
N-[(1R,2R)-2-aminocyclohexyl]-6-oxopiperidine-3-carboxamide
CID 103805817
N-[2-(aminomethyl)cyclopentyl]oxane-4-carboxamide;hydrochloride
CID 119600451
N-[2-(aminomethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 119603187
6-oxopiperidine-3-carbohydrazide
CID 126970948
N-[2-(aminomethyl)cyclohexyl]thiane-4-carboxamide
CID 119612086
N-(2-aminoethyl)-6-oxopiperidine-3-carboxamide
CID 81459337
6-oxo-N-(5-oxopyrrolidin-3-yl)piperidine-3-carboxamide
CID 104580966
4-[[2-(aminomethyl)cyclopentyl]amino]pyrrolidin-2-one
CID 106184314
cis-(1R,3S)-3-[(6-oxopiperidine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106321143
[(1S,2R)-2-(aminomethyl)cyclopentyl]urea
CID 94903973
N-[2-(aminomethyl)cyclopentyl]-1-(4-methylcyclohexyl)-5-oxopyrrolidine-3-carboxamide;hydrochloride
CID 119600923

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride (CID 119604175) is N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride is Cl.NCC1CCCC1NC(=O)C1CCC(=O)NC1.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride?
The InChIKey is BTFUFBYBGUUBPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2.ClH/c13-6-8-2-1-3-10(8)15-12(17)9-4-5-11(16)14-7-9;/h8-10H,1-7,13H2,(H,14,16)(H,15,17);1H.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride?
N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride has a molecular weight of 275.78 g/mol, XLogP of 0.18, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-6-oxopiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119604175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).