(4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one

C9H11N3O — CID 124634642

IUPAC(4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one
SMILESNc1ccc([C@@H]2CNC(=O)C2)nc1
InChIInChI=1S/C9H11N3O/c10-7-1-2-8(11-5-7)6-3-9(13)12-4-6/h1-2,5-6H,3-4,10H2,(H,12,13)/t6-/m0/s1
InChIKeyDCYKSVZSKJPCAN-LURJTMIESA-N
MW177.21 g/mol
LogP0.27
Rot. Bonds1

About (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one

(4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one (PubChem CID 124634642) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one
PubChem CID124634642
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name(4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one
SMILESNc1ccc([C@@H]2CNC(=O)C2)nc1
InChIInChI=1S/C9H11N3O/c10-7-1-2-8(11-5-7)6-3-9(13)12-4-6/h1-2,5-6H,3-4,10H2,(H,12,13)/t6-/m0/s1
InChIKeyDCYKSVZSKJPCAN-LURJTMIESA-N
XLogP0.27
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-pyridin-2-ylpyrrolidin-2-one
CID 47002994
6-cyclopropylpyridin-3-amine;hydrochloride
CID 118705214
(4S)-4-(5-amino-3-methyl-2-pyridinyl)pyrrolidin-2-one
CID 124634622
(4R)-4-(6-amino-5-methyl-3-pyridinyl)pyrrolidin-2-one
CID 124634670
5-(6-amino-3-pyridinyl)piperidin-2-one
CID 118045436
(4S)-4-(3-aminophenyl)pyrrolidin-2-one
CID 86315682
4-[4-amino-2-(trifluoromethyl)phenyl]pyrrolidin-2-one
CID 53417785
6-cyclopropylpyridin-3-amine;propanoic acid
CID 174674900
4-(4-cyclopropylphenyl)pyrrolidin-2-one
CID 79978170
6-[(2R)-piperazin-2-yl]pyridin-3-amine
CID 130741907
4-(1-propan-2-yltriazol-4-yl)pyrrolidin-2-one
CID 130549123
4-(3-amino-5-methylphenyl)pyrrolidin-2-one
CID 167592266

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one?
The IUPAC name of (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one (CID 124634642) is (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one.
What is the SMILES notation for (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one?
The canonical SMILES for (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one is Nc1ccc([C@@H]2CNC(=O)C2)nc1.
What is the InChIKey of (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one?
The InChIKey is DCYKSVZSKJPCAN-LURJTMIESA-N. The full InChI is InChI=1S/C9H11N3O/c10-7-1-2-8(11-5-7)6-3-9(13)12-4-6/h1-2,5-6H,3-4,10H2,(H,12,13)/t6-/m0/s1.
What are the key properties of (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one?
(4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one has a molecular weight of 177.21 g/mol, XLogP of 0.27, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one is sourced from PubChem (CID 124634642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).