(2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide

C19H25N5O3 — CID 162396253

About (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide

(2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide (PubChem CID 162396253) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide.

Molecular Properties

• Compound Name: (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide
• PubChem CID: 162396253
• Molecular Formula: C19H25N5O3
• Molecular Weight: 371.44 g/mol
• Exact Mass: 371.20
• IUPAC Name: (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide
• SMILES: Cc1ccn([C@H](CC2CC2)C(=O)N[C@H](C#N)C[C@@H]2CCNC2=O)c(=O)c1N
• InChI: InChI=1S/C19H25N5O3/c1-11-5-7-24(19(27)16(11)21)15(8-12-2-3-12)18(26)23-14(10-20)9-13-4-6-22-17(13)25/h5,7,12-15H,2-4,6,8-9,21H2,1H3,(H,22,25)(H,23,26)/t13-,14-,15+/m0/s1
• InChIKey: ZFABOFOQNCVZFC-SOUVJXGZSA-N
• XLogP: 0.61
• TPSA: 130.01 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	371.44
LogP ≤ 5	0.61
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide?

The IUPAC name of (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide (CID 162396253) is (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide.

What is the SMILES notation for (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide?

The canonical SMILES for (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide is Cc1ccn([C@H](CC2CC2)C(=O)N[C@H](C#N)C[C@@H]2CCNC2=O)c(=O)c1N.

What is the InChIKey of (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide?

The InChIKey is ZFABOFOQNCVZFC-SOUVJXGZSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-11-5-7-24(19(27)16(11)21)15(8-12-2-3-12)18(26)23-14(10-20)9-13-4-6-22-17(13)25/h5,7,12-15H,2-4,6,8-9,21H2,1H3,(H,22,25)(H,23,26)/t13-,14-,15+/m0/s1.

What are the key properties of (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide?

(2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide has a molecular weight of 371.44 g/mol, XLogP of 0.61, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-2-(3-amino-4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-3-cyclopropylpropanamide is sourced from PubChem (CID 162396253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).