(3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone

C18H26N2O — CID 119785073

IUPAC(3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone
SMILESCc1ccc(C2CCCCN2C(=O)C2CCC(N)C2)cc1
InChIInChI=1S/C18H26N2O/c1-13-5-7-14(8-6-13)17-4-2-3-11-20(17)18(21)15-9-10-16(19)12-15/h5-8,15-17H,2-4,9-12,19H2,1H3
InChIKeyRPYVLHOWUMXRNJ-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.18
Rot. Bonds2

About (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone

(3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone (PubChem CID 119785073) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone
PubChem CID119785073
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name(3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone
SMILESCc1ccc(C2CCCCN2C(=O)C2CCC(N)C2)cc1
InChIInChI=1S/C18H26N2O/c1-13-5-7-14(8-6-13)17-4-2-3-11-20(17)18(21)15-9-10-16(19)12-15/h5-8,15-17H,2-4,9-12,19H2,1H3
InChIKeyRPYVLHOWUMXRNJ-UHFFFAOYSA-N
XLogP3.18
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-aminocyclohexyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone;hydrochloride
CID 119785074
(3-aminocyclopentyl)-(2-phenylpyrrolidin-1-yl)methanone;hydrochloride
CID 119698902
(3-aminocyclopentyl)-[3-(4-methylphenyl)thiomorpholin-4-yl]methanone
CID 119788984
(3-aminocyclohexyl)-[2-(4-methoxyphenyl)azepan-1-yl]methanone
CID 119695947
2-(4-methylphenyl)piperidine-1-carboxylic acid
CID 142773311
1-[2-(4-methylphenyl)piperidin-1-yl]ethanone
CID 127352065
(3-aminocyclopentyl)-[2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methanone
CID 119877945
[(1R,3R)-3-aminocyclopentyl]-[(2S)-2-(2-methylphenyl)pyrrolidin-1-yl]methanone
CID 124678566
(3-aminocyclopentyl)-[2-[(4-methylphenyl)methyl]pyrrolidin-1-yl]methanone;hydrochloride
CID 119771492
(3-aminocyclohexyl)-[2-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;hydrochloride
CID 119687293
(3-aminocyclohexyl)-[3-methyl-2-(4-methylphenyl)piperidin-1-yl]methanone;hydrochloride
CID 119796649
3-amino-2-methyl-1-[2-(4-methylphenyl)piperidin-1-yl]butan-1-one;hydrochloride
CID 120500863

Frequently Asked Questions

What is the IUPAC name of (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone?
The IUPAC name of (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone (CID 119785073) is (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone.
What is the SMILES notation for (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone?
The canonical SMILES for (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone is Cc1ccc(C2CCCCN2C(=O)C2CCC(N)C2)cc1.
What is the InChIKey of (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone?
The InChIKey is RPYVLHOWUMXRNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-13-5-7-14(8-6-13)17-4-2-3-11-20(17)18(21)15-9-10-16(19)12-15/h5-8,15-17H,2-4,9-12,19H2,1H3.
What are the key properties of (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone?
(3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone has a molecular weight of 286.42 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminocyclopentyl)-[2-(4-methylphenyl)piperidin-1-yl]methanone is sourced from PubChem (CID 119785073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).