1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride

C8H16ClNO — CID 86775853

IUPAC1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride
SMILESCC(=O)C1(CN)CCCC1.Cl
InChIInChI=1S/C8H15NO.ClH/c1-7(10)8(6-9)4-2-3-5-8;/h2-6,9H2,1H3;1H
InChIKeyVYCBHTASGVVMQM-UHFFFAOYSA-N
MW177.67 g/mol
LogP1.52
Rot. Bonds2

About 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride

1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride (PubChem CID 86775853) has the molecular formula C8H16ClNO and a molecular weight of 177.67 g/mol. Its IUPAC name is 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride.

Molecular Properties

Compound Name1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride
PubChem CID86775853
Molecular FormulaC8H16ClNO
Molecular Weight177.67 g/mol
Exact Mass177.09
IUPAC Name1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride
SMILESCC(=O)C1(CN)CCCC1.Cl
InChIInChI=1S/C8H15NO.ClH/c1-7(10)8(6-9)4-2-3-5-8;/h2-6,9H2,1H3;1H
InChIKeyVYCBHTASGVVMQM-UHFFFAOYSA-N
XLogP1.52
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.67
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(aminomethyl)-1-methylpiperidin-4-yl]ethanone
CID 178047336
1-[1-(aminomethyl)cyclopentyl]propan-1-one
CID 116600810
1-(aminomethyl)cyclopentane-1-carbonyl chloride
CID 45081354
1-(aminomethyl)-N,N-dimethylcyclopentane-1-carboxamide
CID 54593229
1-(aminomethyl)cyclohexane-1-carbonyl chloride
CID 142629542
1-[3-(aminomethyl)oxetan-3-yl]ethanone
CID 116922670
methyl 1-(aminomethyl)cyclobutane-1-carboxylate;hydrochloride
CID 43811188
1-(aminomethyl)cyclobutane-1-carboxylic acid
CID 23405971
1-[1-(aminomethyl)cyclobutyl]propan-1-one
CID 116600219
4-(1-acetylcyclopentyl)butan-2-one
CID 123974619
1-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)cyclopentane-1-carboxamide;hydrochloride
CID 119819128
[[amino-[1-(aminomethyl)cyclohexyl]methylidene]amino] acetate
CID 173313757

Frequently Asked Questions

What is the IUPAC name of 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride?
The IUPAC name of 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride (CID 86775853) is 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride.
What is the SMILES notation for 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride?
The canonical SMILES for 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride is CC(=O)C1(CN)CCCC1.Cl.
What is the InChIKey of 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride?
The InChIKey is VYCBHTASGVVMQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.ClH/c1-7(10)8(6-9)4-2-3-5-8;/h2-6,9H2,1H3;1H.
What are the key properties of 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride?
1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride has a molecular weight of 177.67 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride is sourced from PubChem (CID 86775853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).