2-amino-N-(2-methylphenyl)quinoline-4-carboxamide

C17H15N3O — CID 62154395

IUPAC2-amino-N-(2-methylphenyl)quinoline-4-carboxamide
SMILESCc1ccccc1NC(=O)c1cc(N)nc2ccccc12
InChIInChI=1S/C17H15N3O/c1-11-6-2-4-8-14(11)20-17(21)13-10-16(18)19-15-9-5-3-7-12(13)15/h2-10H,1H3,(H2,18,19)(H,20,21)
InChIKeyYSBIVMNUOYAPPC-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.38
Rot. Bonds2

About 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide

2-amino-N-(2-methylphenyl)quinoline-4-carboxamide (PubChem CID 62154395) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-methylphenyl)quinoline-4-carboxamide
PubChem CID62154395
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name2-amino-N-(2-methylphenyl)quinoline-4-carboxamide
SMILESCc1ccccc1NC(=O)c1cc(N)nc2ccccc12
InChIInChI=1S/C17H15N3O/c1-11-6-2-4-8-14(11)20-17(21)13-10-16(18)19-15-9-5-3-7-12(13)15/h2-10H,1H3,(H2,18,19)(H,20,21)
InChIKeyYSBIVMNUOYAPPC-UHFFFAOYSA-N
XLogP3.38
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-chlorophenyl)quinoline-4-carboxamide
CID 62155570
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
2-amino-N-tert-butylquinoline-4-carboxamide
CID 62156554
2-(4-acetamidophenyl)-N-(2-methylphenyl)quinoline-4-carboxamide
CID 50816172
2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide
CID 62160962
2-(3-methoxyphenyl)-N-(2-methylphenyl)quinoline-4-carboxamide
CID 1220289
N-(2,4-dimethylphenyl)-2-phenylquinoline-4-carboxamide
CID 3480982
N-(2,3-dimethylphenyl)-2-(4-phenylphenyl)quinoline-4-carboxamide
CID 5129728
2-amino-6-methyl-N-(2-methylphenyl)pyridine-4-carboxamide
CID 113378981
2-methyl-N-(2-methylquinolin-4-yl)benzamide
CID 3291896
N-(2-chlorophenyl)-2-methylquinoline-4-carboxamide
CID 856039
2-(2,4-dimethylphenyl)-N-[2-[[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]amino]phenyl]quinoline-4-carboxamide
CID 4178944

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide?
The IUPAC name of 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide (CID 62154395) is 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide?
The canonical SMILES for 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide is Cc1ccccc1NC(=O)c1cc(N)nc2ccccc12.
What is the InChIKey of 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide?
The InChIKey is YSBIVMNUOYAPPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-11-6-2-4-8-14(11)20-17(21)13-10-16(18)19-15-9-5-3-7-12(13)15/h2-10H,1H3,(H2,18,19)(H,20,21).
What are the key properties of 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide?
2-amino-N-(2-methylphenyl)quinoline-4-carboxamide has a molecular weight of 277.33 g/mol, XLogP of 3.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methylphenyl)quinoline-4-carboxamide is sourced from PubChem (CID 62154395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).