4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one

C11H15N3O — CID 168660066

IUPAC4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
SMILESCc1cc(N2CC(CN)CC2=O)ccn1
InChIInChI=1S/C11H15N3O/c1-8-4-10(2-3-13-8)14-7-9(6-12)5-11(14)15/h2-4,9H,5-7,12H2,1H3
InChIKeyLLXZYJWCBIYOLJ-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.70
Rot. Bonds2

About 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one

4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one (PubChem CID 168660066) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
PubChem CID168660066
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
SMILESCc1cc(N2CC(CN)CC2=O)ccn1
InChIInChI=1S/C11H15N3O/c1-8-4-10(2-3-13-8)14-7-9(6-12)5-11(14)15/h2-4,9H,5-7,12H2,1H3
InChIKeyLLXZYJWCBIYOLJ-UHFFFAOYSA-N
XLogP0.70
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-1-(1-methylbenzimidazol-5-yl)pyrrolidin-2-one
CID 83543998
4-(aminomethyl)-1-[4-(2-methylimidazol-1-yl)phenyl]pyrrolidin-2-one
CID 168660067
4-(aminomethyl)-1-(3,5-difluoro-4-methylphenyl)pyrrolidin-2-one
CID 168659727
4-(aminomethyl)-1-(3-pyrazol-1-ylphenyl)pyrrolidin-2-one
CID 168661209
5-[4-(aminomethyl)-2-oxopyrrolidin-1-yl]-2-methylbenzoic acid
CID 168659844
4-(aminomethyl)-1-(1-methylindazol-5-yl)pyrrolidin-2-one
CID 168660104
4-(aminomethyl)-1-(1-methylindazol-6-yl)pyrrolidin-2-one
CID 168660102
4-(aminomethyl)-1-(3-bromo-5-methylphenyl)pyrrolidin-2-one
CID 107579655
1-(2-bromo-4-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168663955
5-[4-(aminomethyl)-2-oxopyrrolidin-1-yl]-2,3-dihydroisoindol-1-one
CID 168660659
4-(aminomethyl)-1-(1-methylindol-5-yl)pyrrolidin-2-one
CID 168660089
4-(aminomethyl)-1-(2-methylindazol-5-yl)pyrrolidin-2-one
CID 168660099

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one?
The IUPAC name of 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one (CID 168660066) is 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one.
What is the SMILES notation for 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one?
The canonical SMILES for 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one is Cc1cc(N2CC(CN)CC2=O)ccn1.
What is the InChIKey of 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one?
The InChIKey is LLXZYJWCBIYOLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8-4-10(2-3-13-8)14-7-9(6-12)5-11(14)15/h2-4,9H,5-7,12H2,1H3.
What are the key properties of 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one?
4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one has a molecular weight of 205.26 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1-(2-methyl-4-pyridinyl)pyrrolidin-2-one is sourced from PubChem (CID 168660066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).