N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide

C17H20N4O — CID 166222406

IUPACN-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide
SMILESO=C(c1ccnc(-n2ccnc2)c1)N(CC1CC1)C1CCC1
InChIInChI=1S/C17H20N4O/c22-17(21(11-13-4-5-13)15-2-1-3-15)14-6-7-19-16(10-14)20-9-8-18-12-20/h6-10,12-13,15H,1-5,11H2
InChIKeyFDPXWYZNASYAIV-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.67
Rot. Bonds5

About N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide

N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide (PubChem CID 166222406) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide
PubChem CID166222406
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide
SMILESO=C(c1ccnc(-n2ccnc2)c1)N(CC1CC1)C1CCC1
InChIInChI=1S/C17H20N4O/c22-17(21(11-13-4-5-13)15-2-1-3-15)14-6-7-19-16(10-14)20-9-8-18-12-20/h6-10,12-13,15H,1-5,11H2
InChIKeyFDPXWYZNASYAIV-UHFFFAOYSA-N
XLogP2.67
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-imidazol-1-yl-N-methyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-4-carboxamide
CID 94816782
(4-cyclobutyl-4-hydroxypiperidin-1-yl)-(2-imidazol-1-yl-4-pyridinyl)methanone
CID 136566028
2-(cyclopropylmethylamino)-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]acetamide;dihydrochloride
CID 119859974
N-(2,3-dihydro-1H-inden-1-yl)-2-imidazol-1-yl-N-methylpyridine-4-carboxamide
CID 51085905
[(4aR,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-(2-imidazol-1-yl-4-pyridinyl)methanone
CID 95580405
[2-(aminomethyl)piperidin-1-yl]-(2-imidazol-1-yl-4-pyridinyl)methanone;dihydrochloride
CID 119469483
N-(2-amino-1-cyclohexylethyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 119591870
2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide
CID 51085889
2-imidazol-1-yl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 51089957
2-imidazol-1-yl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]pyridine-4-carboxamide
CID 94180241
1-[(2-hydroxycyclopentyl)methyl]-3-[(2-imidazol-1-yl-4-pyridinyl)methyl]-1-methylurea
CID 109398554
N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 87010836

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide?
The IUPAC name of N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide (CID 166222406) is N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide.
What is the SMILES notation for N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide?
The canonical SMILES for N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide is O=C(c1ccnc(-n2ccnc2)c1)N(CC1CC1)C1CCC1.
What is the InChIKey of N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide?
The InChIKey is FDPXWYZNASYAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c22-17(21(11-13-4-5-13)15-2-1-3-15)14-6-7-19-16(10-14)20-9-8-18-12-20/h6-10,12-13,15H,1-5,11H2.
What are the key properties of N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide?
N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.67, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide is sourced from PubChem (CID 166222406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).