N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide

C19H18N2O — CID 142402757

IUPACN-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide
SMILESCc1cccc2cccc(C(=O)N(C)c3ccccc3N)c12
InChIInChI=1S/C19H18N2O/c1-13-7-5-8-14-9-6-10-15(18(13)14)19(22)21(2)17-12-4-3-11-16(17)20/h3-12H,20H2,1-2H3
InChIKeyIXUMZZCRXUFXDK-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.01
Rot. Bonds2

About N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide

N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide (PubChem CID 142402757) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide
PubChem CID142402757
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC NameN-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide
SMILESCc1cccc2cccc(C(=O)N(C)c3ccccc3N)c12
InChIInChI=1S/C19H18N2O/c1-13-7-5-8-14-9-6-10-15(18(13)14)19(22)21(2)17-12-4-3-11-16(17)20/h3-12H,20H2,1-2H3
InChIKeyIXUMZZCRXUFXDK-UHFFFAOYSA-N
XLogP4.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminophenyl)-N,2,6-trimethylpyridine-3-carboxamide
CID 62831116
2-hydroxy-N-methyl-N-(2-methylphenyl)benzamide
CID 20668349
2-amino-N-(2-hydroxyphenyl)-N-methylbenzamide
CID 140987433
N,2-dimethyl-N-(2-methylphenyl)benzamide
CID 71395326
2-[(2-aminobenzoyl)-methylamino]benzoic acid
CID 12819851
N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide
CID 81446196
N-ethyl-8-methylnaphthalene-1-carboxamide
CID 21338721
N-(2-amino-5-chlorophenyl)-2-hydroxy-N,3-dimethylbenzamide
CID 107465659
2-amino-4-bromo-N-methyl-N-(2-methylphenyl)benzamide
CID 79721752
2-amino-N-(2,6-dichloro-3-pyridinyl)-N-methylbenzamide
CID 118279157
N-(2-aminophenyl)-3-methoxy-N-methylthiophene-2-carboxamide
CID 81117473
4-acetamido-N-(2-aminophenyl)-N-methylbenzamide
CID 143459430

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide?
The IUPAC name of N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide (CID 142402757) is N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide.
What is the SMILES notation for N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide?
The canonical SMILES for N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide is Cc1cccc2cccc(C(=O)N(C)c3ccccc3N)c12.
What is the InChIKey of N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide?
The InChIKey is IXUMZZCRXUFXDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-13-7-5-8-14-9-6-10-15(18(13)14)19(22)21(2)17-12-4-3-11-16(17)20/h3-12H,20H2,1-2H3.
What are the key properties of N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide?
N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-N,8-dimethylnaphthalene-1-carboxamide is sourced from PubChem (CID 142402757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).