N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide

C15H20N4O2 — CID 95141147

IUPACN-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide
SMILESCC(C)[C@H](Cn1ccnc1)NC(=O)c1ccc(=O)n(C)c1
InChIInChI=1S/C15H20N4O2/c1-11(2)13(9-19-7-6-16-10-19)17-15(21)12-4-5-14(20)18(3)8-12/h4-8,10-11,13H,9H2,1-3H3,(H,17,21)/t13-/m0/s1
InChIKeyNXKNOLHDWNSZMH-ZDUSSCGKSA-N
MW288.35 g/mol
LogP1.04
Rot. Bonds5

About N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide

N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide (PubChem CID 95141147) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide
PubChem CID95141147
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide
SMILESCC(C)[C@H](Cn1ccnc1)NC(=O)c1ccc(=O)n(C)c1
InChIInChI=1S/C15H20N4O2/c1-11(2)13(9-19-7-6-16-10-19)17-15(21)12-4-5-14(20)18(3)8-12/h4-8,10-11,13H,9H2,1-3H3,(H,17,21)/t13-/m0/s1
InChIKeyNXKNOLHDWNSZMH-ZDUSSCGKSA-N
XLogP1.04
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide (CID 95141147) is N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide is CC(C)[C@H](Cn1ccnc1)NC(=O)c1ccc(=O)n(C)c1.
What is the InChIKey of N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is NXKNOLHDWNSZMH-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-11(2)13(9-19-7-6-16-10-19)17-15(21)12-4-5-14(20)18(3)8-12/h4-8,10-11,13H,9H2,1-3H3,(H,17,21)/t13-/m0/s1.
What are the key properties of N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide?
N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 95141147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).