N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide

C15H20N4O2 — CID 86287209

IUPACN-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCC(Cn1ccnc1)NC(=O)c1c(C)cc(C)[nH]c1=O
InChIInChI=1S/C15H20N4O2/c1-4-12(8-19-6-5-16-9-19)18-15(21)13-10(2)7-11(3)17-14(13)20/h5-7,9,12H,4,8H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyKVOCHSBGMKBJSW-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.40
Rot. Bonds5

About N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide

N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 86287209) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID86287209
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCC(Cn1ccnc1)NC(=O)c1c(C)cc(C)[nH]c1=O
InChIInChI=1S/C15H20N4O2/c1-4-12(8-19-6-5-16-9-19)18-15(21)13-10(2)7-11(3)17-14(13)20/h5-7,9,12H,4,8H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyKVOCHSBGMKBJSW-UHFFFAOYSA-N
XLogP1.40
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide (CID 86287209) is N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide is CCC(Cn1ccnc1)NC(=O)c1c(C)cc(C)[nH]c1=O.
What is the InChIKey of N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is KVOCHSBGMKBJSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-12(8-19-6-5-16-9-19)18-15(21)13-10(2)7-11(3)17-14(13)20/h5-7,9,12H,4,8H2,1-3H3,(H,17,20)(H,18,21).
What are the key properties of N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.40, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-imidazol-1-ylbutan-2-yl)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 86287209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).