N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide

C13H14N4O — CID 47152532

IUPACN-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide
SMILESO=C(NCC1CC1)c1ccc(-n2ccnc2)nc1
InChIInChI=1S/C13H14N4O/c18-13(16-7-10-1-2-10)11-3-4-12(15-8-11)17-6-5-14-9-17/h3-6,8-10H,1-2,7H2,(H,16,18)
InChIKeyQXHNIZCOODMZEM-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.41
Rot. Bonds4

About N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide

N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide (PubChem CID 47152532) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide
PubChem CID47152532
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC NameN-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide
SMILESO=C(NCC1CC1)c1ccc(-n2ccnc2)nc1
InChIInChI=1S/C13H14N4O/c18-13(16-7-10-1-2-10)11-3-4-12(15-8-11)17-6-5-14-9-17/h3-6,8-10H,1-2,7H2,(H,16,18)
InChIKeyQXHNIZCOODMZEM-UHFFFAOYSA-N
XLogP1.41
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-hydroxycyclopentyl)methyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 103279750
N-ethyl-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152181
2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide
CID 60867461
6-imidazol-1-yl-N-(2-methylsulfanylethyl)pyridine-3-carboxamide
CID 23594782
N-(2,2-difluoro-3-hydroxypropyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 104862732
N-[(1-hydroxycycloheptyl)methyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 111428654
ethane;6-imidazol-1-yl-N-methylpyridine-3-carboxamide
CID 142231779
3-[(6-imidazol-1-ylpyridine-3-carbonyl)amino]-2,2-dimethylpropanoic acid
CID 115427337
6-imidazol-1-yl-N-[[(1'R,3R)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]methyl]pyridine-3-carboxamide
CID 97053267
N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide
CID 51107519
N-(2-hydroxy-2-propylpentyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 111444790
6-imidazol-1-yl-N-[(2S)-2-morpholin-4-ylpropyl]pyridine-3-carboxamide
CID 129367054

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide (CID 47152532) is N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide is O=C(NCC1CC1)c1ccc(-n2ccnc2)nc1.
What is the InChIKey of N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide?
The InChIKey is QXHNIZCOODMZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c18-13(16-7-10-1-2-10)11-3-4-12(15-8-11)17-6-5-14-9-17/h3-6,8-10H,1-2,7H2,(H,16,18).
What are the key properties of N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide?
N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 47152532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).