N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide

C14H12N4O2 — CID 155553456

IUPACN-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)Nc3ncc[nH]3)cnc2c1
InChIInChI=1S/C14H12N4O2/c1-20-11-3-2-9-6-10(8-17-12(9)7-11)13(19)18-14-15-4-5-16-14/h2-8H,1H3,(H2,15,16,18,19)
InChIKeyKUSZKBIUOLVLHP-UHFFFAOYSA-N
MW268.28 g/mol
LogP2.22
Rot. Bonds3

About N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide

N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide (PubChem CID 155553456) has the molecular formula C14H12N4O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide
PubChem CID155553456
Molecular FormulaC14H12N4O2
Molecular Weight268.28 g/mol
Exact Mass268.10
IUPAC NameN-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)Nc3ncc[nH]3)cnc2c1
InChIInChI=1S/C14H12N4O2/c1-20-11-3-2-9-6-10(8-17-12(9)7-11)13(19)18-14-15-4-5-16-14/h2-8H,1H3,(H2,15,16,18,19)
InChIKeyKUSZKBIUOLVLHP-UHFFFAOYSA-N
XLogP2.22
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(S)-N-(1-(5-(2-methoxyquinolin-3-yl)-1H-imidazol-2-yl)-7-oxooctyl)-1-methylazetidine-3-carboxamide
CID 11556677
5-[[(3R,4R)-3-aminooxan-4-yl]amino]-3-(4-methoxy-1H-indol-2-yl)pyrazine-2-carboxamide
CID 118368174
7-methoxy-3-(pyridin-4-ylmethyl)-5H-pyrimido[5,4-b]indol-4-one
CID 937984
Piperazine, 1-((6-methoxy-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-
CID 453390
Pyrrolo-pyrimidone, 4
CID 135874060
3-(3-Imidazol-1-yl-propyl)-7-methoxy-3,5-dihydro-pyrimido[5,4-b]indol-4-one
CID 932398
2-(4-ethoxyphenyl)-N-[3-(1-imidazolyl)propyl]-4-quinolinecarboxamide
CID 3728297
(S)-N-(1-(5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl)-7-oxooctyl)-1-methylazetidine-3-carboxamide
CID 11628528
(S)-N-(1-(5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl)-7-oxooctyl)-1-methylpiperidine-4-carboxamide
CID 44157820
(S)-N-(1-(5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl)-7-oxooctyl)-3-(4-methylpiperazin-1-yl)propanamide
CID 44157821
(S)-3-(dimethylamino)-N-(1-(5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl)-7-oxooctyl)propanamide
CID 44158080
1-(1H-indol-3-yl)-2-((3-methoxyphenyl)amino)-2-(pyrimidin-5-yl)ethanone
CID 86728618

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide?
The IUPAC name of N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide (CID 155553456) is N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide.
What is the SMILES notation for N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide?
The canonical SMILES for N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide is COc1ccc2cc(C(=O)Nc3ncc[nH]3)cnc2c1.
What is the InChIKey of N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide?
The InChIKey is KUSZKBIUOLVLHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O2/c1-20-11-3-2-9-6-10(8-17-12(9)7-11)13(19)18-14-15-4-5-16-14/h2-8H,1H3,(H2,15,16,18,19).
What are the key properties of N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide?
N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide has a molecular weight of 268.28 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-yl)-7-methoxyquinoline-3-carboxamide is sourced from PubChem (CID 155553456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).