N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide

C17H24N4O — CID 23588390

IUPACN-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)N(CC(C)(C)C)C(=O)c1ccc(-n2ccnc2)nc1
InChIInChI=1S/C17H24N4O/c1-13(2)21(11-17(3,4)5)16(22)14-6-7-15(19-10-14)20-9-8-18-12-20/h6-10,12-13H,11H2,1-5H3
InChIKeyBMJUEPYLQVSOID-UHFFFAOYSA-N
MW300.41 g/mol
LogP3.16
Rot. Bonds4

About N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide

N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide (PubChem CID 23588390) has the molecular formula C17H24N4O and a molecular weight of 300.41 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide
PubChem CID23588390
Molecular FormulaC17H24N4O
Molecular Weight300.41 g/mol
Exact Mass300.20
IUPAC NameN-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)N(CC(C)(C)C)C(=O)c1ccc(-n2ccnc2)nc1
InChIInChI=1S/C17H24N4O/c1-13(2)21(11-17(3,4)5)16(22)14-6-7-15(19-10-14)20-9-8-18-12-20/h6-10,12-13H,11H2,1-5H3
InChIKeyBMJUEPYLQVSOID-UHFFFAOYSA-N
XLogP3.16
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[(1R,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]methyl]-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide
CID 98163864
N-(1-aminopropan-2-yl)-6-imidazol-1-yl-N-methylpyridine-3-carboxamide;dihydrochloride
CID 119584534
N-(2-aminoethyl)-6-imidazol-1-yl-N-methylpyridine-3-carboxamide;methanamine
CID 142231842
N-ethyl-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152181
3-[(6-imidazol-1-ylpyridine-3-carbonyl)amino]-2,2-dimethylpropanoic acid
CID 115427337
3-[ethyl-(6-imidazol-1-ylpyridine-3-carbonyl)amino]propanoic acid
CID 61006797
2-[(6-imidazol-1-ylpyridine-3-carbonyl)amino]propanoic acid
CID 43355195
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 79246612
ethane;6-imidazol-1-yl-N-methylpyridine-3-carboxamide
CID 142231779
6-imidazol-1-yl-N-methyl-N-[(1-phenylcyclopropyl)methyl]pyridine-3-carboxamide
CID 99823272
N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 60555147
6-imidazol-1-yl-N-(2-methylsulfanylethyl)pyridine-3-carboxamide
CID 23594782

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide (CID 23588390) is N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide is CC(C)N(CC(C)(C)C)C(=O)c1ccc(-n2ccnc2)nc1.
What is the InChIKey of N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide?
The InChIKey is BMJUEPYLQVSOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O/c1-13(2)21(11-17(3,4)5)16(22)14-6-7-15(19-10-14)20-9-8-18-12-20/h6-10,12-13H,11H2,1-5H3.
What are the key properties of N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide?
N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide has a molecular weight of 300.41 g/mol, XLogP of 3.16, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-6-imidazol-1-yl-N-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 23588390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).