N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide

C15H15N3O2 — CID 175946234

IUPACN-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide
SMILESC[C@H]1C[C@@H]1n1cccc(NC(=O)c2ccccn2)c1=O
InChIInChI=1S/C15H15N3O2/c1-10-9-13(10)18-8-4-6-12(15(18)20)17-14(19)11-5-2-3-7-16-11/h2-8,10,13H,9H2,1H3,(H,17,19)/t10-,13-/m0/s1
InChIKeyCGENCDGQVIWDKA-GWCFXTLKSA-N
MW269.30 g/mol
LogP2.08
Rot. Bonds3

About N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide

N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide (PubChem CID 175946234) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide
PubChem CID175946234
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide
SMILESC[C@H]1C[C@@H]1n1cccc(NC(=O)c2ccccn2)c1=O
InChIInChI=1S/C15H15N3O2/c1-10-9-13(10)18-8-4-6-12(15(18)20)17-14(19)11-5-2-3-7-16-11/h2-8,10,13H,9H2,1H3,(H,17,19)/t10-,13-/m0/s1
InChIKeyCGENCDGQVIWDKA-GWCFXTLKSA-N
XLogP2.08
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide?
The IUPAC name of N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide (CID 175946234) is N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide is C[C@H]1C[C@@H]1n1cccc(NC(=O)c2ccccn2)c1=O.
What is the InChIKey of N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide?
The InChIKey is CGENCDGQVIWDKA-GWCFXTLKSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-10-9-13(10)18-8-4-6-12(15(18)20)17-14(19)11-5-2-3-7-16-11/h2-8,10,13H,9H2,1H3,(H,17,19)/t10-,13-/m0/s1.
What are the key properties of N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide?
N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(1S,2S)-2-methylcyclopropyl]-2-oxo-3-pyridinyl]pyridine-2-carboxamide is sourced from PubChem (CID 175946234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).