N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide

C15H14N4O — CID 63930575

IUPACN-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide
SMILESCN(Cc1ncc[nH]1)C(=O)c1ccc2ccccc2n1
InChIInChI=1S/C15H14N4O/c1-19(10-14-16-8-9-17-14)15(20)13-7-6-11-4-2-3-5-12(11)18-13/h2-9H,10H2,1H3,(H,16,17)
InChIKeyPWBNVUFOGYBUOM-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.23
Rot. Bonds3

About N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide

N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide (PubChem CID 63930575) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide
PubChem CID63930575
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide
SMILESCN(Cc1ncc[nH]1)C(=O)c1ccc2ccccc2n1
InChIInChI=1S/C15H14N4O/c1-19(10-14-16-8-9-17-14)15(20)13-7-6-11-4-2-3-5-12(11)18-13/h2-9H,10H2,1H3,(H,16,17)
InChIKeyPWBNVUFOGYBUOM-UHFFFAOYSA-N
XLogP2.23
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-imidazol-2-ylmethyl)-N-methylnaphthalene-1-carboxamide
CID 63928694
N-ethyl-N-methylquinoline-2-carboxamide
CID 19793658
N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide
CID 115620186
N-[(2-fluorophenyl)methyl]-N-methylquinoline-2-carboxamide
CID 9409269
5-(ethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-2-carboxamide
CID 104641533
N-(1H-imidazol-2-ylmethyl)-N-methyl-1H-indole-3-carboxamide
CID 63939451
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-naphthalen-2-ylacetamide
CID 63929126
N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide
CID 114230507
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-phenylpyrimidine-5-carboxamide
CID 50954561
N-(1H-benzimidazol-2-ylmethyl)-N-methylpyridine-2-carboxamide
CID 36516329
2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide
CID 64516996
4-[1H-imidazol-2-ylmethyl(methyl)carbamoyl]benzoic acid
CID 64519669

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide?
The IUPAC name of N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide (CID 63930575) is N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide.
What is the SMILES notation for N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide?
The canonical SMILES for N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide is CN(Cc1ncc[nH]1)C(=O)c1ccc2ccccc2n1.
What is the InChIKey of N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide?
The InChIKey is PWBNVUFOGYBUOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-19(10-14-16-8-9-17-14)15(20)13-7-6-11-4-2-3-5-12(11)18-13/h2-9H,10H2,1H3,(H,16,17).
What are the key properties of N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide?
N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide is sourced from PubChem (CID 63930575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).