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

C10H13N3O — CID 43521184

IUPAC4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one
SMILESCc1ccnc(N2CC(N)CC2=O)c1
InChIInChI=1S/C10H13N3O/c1-7-2-3-12-9(4-7)13-6-8(11)5-10(13)14/h2-4,8H,5-6,11H2,1H3
InChIKeyKMJNSQJQOLTWHL-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.45
Rot. Bonds1

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

4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one (PubChem CID 43521184) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one
PubChem CID43521184
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one
SMILESCc1ccnc(N2CC(N)CC2=O)c1
InChIInChI=1S/C10H13N3O/c1-7-2-3-12-9(4-7)13-6-8(11)5-10(13)14/h2-4,8H,5-6,11H2,1H3
InChIKeyKMJNSQJQOLTWHL-UHFFFAOYSA-N
XLogP0.45
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methyl-2-pyridinyl)-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168714555
4-amino-1-(5-iodo-4-methyl-2-pyridinyl)pyrrolidin-2-one
CID 168699714
1-(4-methyl-2-pyridinyl)imidazolidin-2-one
CID 122219864
1-[1-(4-methyl-2-pyridinyl)azetidin-3-yl]pyrrolidine-2,5-dione
CID 121183869
4-amino-1-(5-chloro-2-pyridinyl)pyrrolidin-2-one
CID 43521189
4-amino-1-(3-methyl-4-pyridinyl)pyrrolidin-2-one
CID 168699821
4-amino-1-(3,4-dimethylphenyl)pyrrolidin-2-one;hydrochloride
CID 71779044
4-amino-1-[5-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one
CID 168701326
4-amino-1-(5-phenyl-2-pyridinyl)pyrrolidin-2-one
CID 168700677
1-(4-chloro-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168664302
1-(4-methoxy-2-pyridinyl)-4-(sulfanylmethyl)pyrrolidin-2-one
CID 168670249
4-amino-1-(4-fluoro-2-methylphenyl)pyrrolidin-2-one
CID 43521142

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one?
The IUPAC name of 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one (CID 43521184) is 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one.
What is the SMILES notation for 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one?
The canonical SMILES for 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one is Cc1ccnc(N2CC(N)CC2=O)c1.
What is the InChIKey of 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one?
The InChIKey is KMJNSQJQOLTWHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-7-2-3-12-9(4-7)13-6-8(11)5-10(13)14/h2-4,8H,5-6,11H2,1H3.
What are the key properties of 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one?
4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one has a molecular weight of 191.23 g/mol, XLogP of 0.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(4-methyl-2-pyridinyl)pyrrolidin-2-one is sourced from PubChem (CID 43521184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).