N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide

C15H14N4O — CID 115620186

IUPACN-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide
SMILESO=C(NCCc1ncc[nH]1)c1ccc2ccccc2n1
InChIInChI=1S/C15H14N4O/c20-15(18-8-7-14-16-9-10-17-14)13-6-5-11-3-1-2-4-12(11)19-13/h1-6,9-10H,7-8H2,(H,16,17)(H,18,20)
InChIKeyGHXHVXBWSAVAFW-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.93
Rot. Bonds4

About N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide

N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide (PubChem CID 115620186) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide
PubChem CID115620186
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide
SMILESO=C(NCCc1ncc[nH]1)c1ccc2ccccc2n1
InChIInChI=1S/C15H14N4O/c20-15(18-8-7-14-16-9-10-17-14)13-6-5-11-3-1-2-4-12(11)19-13/h1-6,9-10H,7-8H2,(H,16,17)(H,18,20)
InChIKeyGHXHVXBWSAVAFW-UHFFFAOYSA-N
XLogP1.93
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide
CID 115751977
N-[3-(quinoline-2-carbonylamino)propyl]quinoline-2-carboxamide
CID 11603405
N-[6-(quinoline-2-carbonylamino)hexyl]quinoline-2-carboxamide
CID 139197064
3-amino-N-[2-(1H-imidazol-2-yl)ethyl]naphthalene-2-carboxamide
CID 115741084
N-[2-(4-pyrazol-1-ylphenyl)ethyl]quinoline-2-carboxamide
CID 41412655
N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide
CID 63930575
N-[2-(4-methoxyphenyl)ethyl]quinoline-2-carboxamide
CID 2093012
N-[2-(1H-imidazol-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 115620327
N-[2-(2-chloroethoxy)ethyl]quinoline-2-carboxamide
CID 114297702
N-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)quinoline-2-carboxamide
CID 134791858
N-[2-(1H-imidazol-2-yl)ethyl]-4-oxo-1H-quinoline-3-carboxamide
CID 115620011
N-[2-(1H-imidazol-2-yl)ethyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 115620129

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide?
The IUPAC name of N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide (CID 115620186) is N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide.
What is the SMILES notation for N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide?
The canonical SMILES for N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide is O=C(NCCc1ncc[nH]1)c1ccc2ccccc2n1.
What is the InChIKey of N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide?
The InChIKey is GHXHVXBWSAVAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c20-15(18-8-7-14-16-9-10-17-14)13-6-5-11-3-1-2-4-12(11)19-13/h1-6,9-10H,7-8H2,(H,16,17)(H,18,20).
What are the key properties of N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide?
N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide is sourced from PubChem (CID 115620186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).