N-(imidazol-1-ylmethyl)pyridine-3-carboxamide

C10H10N4O — CID 86179423

IUPACN-(imidazol-1-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCn1ccnc1)c1cccnc1
InChIInChI=1S/C10H10N4O/c15-10(9-2-1-3-11-6-9)13-8-14-5-4-12-7-14/h1-7H,8H2,(H,13,15)
InChIKeyQXYPSVORZZDLQC-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.67
Rot. Bonds3

About N-(imidazol-1-ylmethyl)pyridine-3-carboxamide

N-(imidazol-1-ylmethyl)pyridine-3-carboxamide (PubChem CID 86179423) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is N-(imidazol-1-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(imidazol-1-ylmethyl)pyridine-3-carboxamide
PubChem CID86179423
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC NameN-(imidazol-1-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCn1ccnc1)c1cccnc1
InChIInChI=1S/C10H10N4O/c15-10(9-2-1-3-11-6-9)13-8-14-5-4-12-7-14/h1-7H,8H2,(H,13,15)
InChIKeyQXYPSVORZZDLQC-UHFFFAOYSA-N
XLogP0.67
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-imidazol-1-yl-1-pyridin-3-ylethanone
CID 70494424
N-(benzotriazol-2-ylmethyl)pyridine-3-carboxamide
CID 100991974
N-[(4-imidazol-1-ylphenyl)methyl]pyridine-3-carboxamide
CID 53159079
N-(3-pyrrol-1-ylpropyl)pyridine-3-carboxamide
CID 90500651
N-[4-(5-imidazol-1-ylpentoxy)phenyl]pyridine-3-carboxamide
CID 13219174
N-benzylpyridine-3-carboxamide chloride
CID 21204170
N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;hydrochloride
CID 110755498
N-(2-hydrazinyl-2-oxoethyl)pyridine-3-carboxamide
CID 39070404
N-(3-chloropropyl)pyridine-3-carboxamide
CID 17164667
N-[(2S)-2-hydroxypropyl]pyridine-3-carboxamide
CID 39237258
[4-(2-imidazol-1-ylethyl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 71788592
N-(furan-2-ylmethyl)pyridine-3-carboxamide
CID 1087305

Frequently Asked Questions

What is the IUPAC name of N-(imidazol-1-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-(imidazol-1-ylmethyl)pyridine-3-carboxamide (CID 86179423) is N-(imidazol-1-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(imidazol-1-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(imidazol-1-ylmethyl)pyridine-3-carboxamide is O=C(NCn1ccnc1)c1cccnc1.
What is the InChIKey of N-(imidazol-1-ylmethyl)pyridine-3-carboxamide?
The InChIKey is QXYPSVORZZDLQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c15-10(9-2-1-3-11-6-9)13-8-14-5-4-12-7-14/h1-7H,8H2,(H,13,15).
What are the key properties of N-(imidazol-1-ylmethyl)pyridine-3-carboxamide?
N-(imidazol-1-ylmethyl)pyridine-3-carboxamide has a molecular weight of 202.22 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazol-1-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 86179423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).