2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide

C15H15N5O — CID 63563758

IUPAC2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2ncc[nH]2)c2ccccc2n1
InChIInChI=1S/C15H15N5O/c1-2-16-13-9-11(10-5-3-4-6-12(10)19-13)14(21)20-15-17-7-8-18-15/h3-9H,2H2,1H3,(H,16,19)(H2,17,18,20,21)
InChIKeyCHDJGAZKKDSNCW-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.64
Rot. Bonds4

About 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide

2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide (PubChem CID 63563758) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide
PubChem CID63563758
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2ncc[nH]2)c2ccccc2n1
InChIInChI=1S/C15H15N5O/c1-2-16-13-9-11(10-5-3-4-6-12(10)19-13)14(21)20-15-17-7-8-18-15/h3-9H,2H2,1H3,(H,16,19)(H2,17,18,20,21)
InChIKeyCHDJGAZKKDSNCW-UHFFFAOYSA-N
XLogP2.64
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-imidazol-2-yl)-2-(methylamino)quinoline-4-carboxamide
CID 63563757
6-(ethylamino)-N-(1H-imidazol-2-yl)pyridine-2-carboxamide
CID 55214916
2-(ethylamino)-N-(2-methylbutan-2-yl)quinoline-4-carboxamide
CID 62173209
6-(ethylamino)-N-(1H-imidazol-2-yl)pyridazine-3-carboxamide
CID 63565276
2-(ethylamino)-N-pentan-2-ylquinoline-4-carboxamide
CID 62185765
2-(ethylamino)-N-(2-methylbutyl)quinoline-4-carboxamide
CID 62692096
2-(ethylamino)-N-(2-methoxyethyl)-N-methylquinoline-4-carboxamide
CID 62178126
N-(1H-imidazol-2-yl)-2-methylbenzamide
CID 60968635
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)quinoline-4-carboxamide
CID 117089575
N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide
CID 59292872
2-hydroxy-N-(1H-imidazol-2-yl)-3-methylbenzamide
CID 60968361
N-(2-methoxyethyl)-2-(propylamino)quinoline-4-carboxamide
CID 62170948

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide (CID 63563758) is 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide is CCNc1cc(C(=O)Nc2ncc[nH]2)c2ccccc2n1.
What is the InChIKey of 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide?
The InChIKey is CHDJGAZKKDSNCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-2-16-13-9-11(10-5-3-4-6-12(10)19-13)14(21)20-15-17-7-8-18-15/h3-9H,2H2,1H3,(H,16,19)(H2,17,18,20,21).
What are the key properties of 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide?
2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide has a molecular weight of 281.32 g/mol, XLogP of 2.64, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(1H-imidazol-2-yl)quinoline-4-carboxamide is sourced from PubChem (CID 63563758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).