4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one

C14H22N4O — CID 168660077

IUPAC4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one
SMILESCc1cc(N2CC(CN)CC2=O)n(C2CCCC2)n1
InChIInChI=1S/C14H22N4O/c1-10-6-13(17-9-11(8-15)7-14(17)19)18(16-10)12-4-2-3-5-12/h6,11-12H,2-5,7-9,15H2,1H3
InChIKeyWYYVJVRCOVVIQT-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.62
Rot. Bonds3

About 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one

4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one (PubChem CID 168660077) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one
PubChem CID168660077
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one
SMILESCc1cc(N2CC(CN)CC2=O)n(C2CCCC2)n1
InChIInChI=1S/C14H22N4O/c1-10-6-13(17-9-11(8-15)7-14(17)19)18(16-10)12-4-2-3-5-12/h6,11-12H,2-5,7-9,15H2,1H3
InChIKeyWYYVJVRCOVVIQT-UHFFFAOYSA-N
XLogP1.62
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentyl-5-methylpyrazol-3-amine
CID 3152524
4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
CID 168660066
4-(aminomethyl)-1-(4-chloro-6-methylpyrimidin-2-yl)pyrrolidin-2-one
CID 168659951
7-[4-(aminomethyl)-2-oxopyrrolidin-1-yl]-2-methylpyrazolo[1,5-a]pyrimidine-6-carbonitrile
CID 168659836
4-(hydroxymethyl)-1-(5-methyl-2-phenylpyrazol-3-yl)pyrrolidin-2-one
CID 168662663
4-(aminomethyl)-1-(3,5-difluoro-4-methylphenyl)pyrrolidin-2-one
CID 168659727
4-(chloromethyl)-1-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrrolidin-2-one
CID 168507800
4-(aminomethyl)-1-(5-amino-2-methylphenyl)pyrrolidin-2-one
CID 168659847
4-(aminomethyl)-1-(5-bromo-2-methyl-3-pyridinyl)pyrrolidin-2-one
CID 168659739
4-amino-1-(2-cyclopentylpyrazol-3-yl)pyrrolidin-2-one
CID 168701206
4-(aminomethyl)-1-(3-bromo-5-methylphenyl)pyrrolidin-2-one
CID 107579655
4-(aminomethyl)-1-[5-(4-methylphenyl)-1H-pyrazol-3-yl]pyrrolidin-2-one
CID 168659810

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one?
The IUPAC name of 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one (CID 168660077) is 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one.
What is the SMILES notation for 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one?
The canonical SMILES for 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one is Cc1cc(N2CC(CN)CC2=O)n(C2CCCC2)n1.
What is the InChIKey of 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one?
The InChIKey is WYYVJVRCOVVIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-6-13(17-9-11(8-15)7-14(17)19)18(16-10)12-4-2-3-5-12/h6,11-12H,2-5,7-9,15H2,1H3.
What are the key properties of 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one?
4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one has a molecular weight of 262.36 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1-(2-cyclopentyl-5-methylpyrazol-3-yl)pyrrolidin-2-one is sourced from PubChem (CID 168660077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).