N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide

C25H20N2O3 — CID 34636649

IUPACN-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide
SMILESCOc1ccccc1NC(=O)c1cccc(NC(=O)c2cccc3ccccc23)c1
InChIInChI=1S/C25H20N2O3/c1-30-23-15-5-4-14-22(23)27-24(28)18-10-6-11-19(16-18)26-25(29)21-13-7-9-17-8-2-3-12-20(17)21/h2-16H,1H3,(H,26,29)(H,27,28)
InChIKeyKXGHYBAPGJIUGU-UHFFFAOYSA-N
MW396.45 g/mol
LogP5.35
Rot. Bonds5

About N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide

N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide (PubChem CID 34636649) has the molecular formula C25H20N2O3 and a molecular weight of 396.45 g/mol. Its IUPAC name is N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide
PubChem CID34636649
Molecular FormulaC25H20N2O3
Molecular Weight396.45 g/mol
Exact Mass396.15
IUPAC NameN-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide
SMILESCOc1ccccc1NC(=O)c1cccc(NC(=O)c2cccc3ccccc23)c1
InChIInChI=1S/C25H20N2O3/c1-30-23-15-5-4-14-22(23)27-24(28)18-10-6-11-19(16-18)26-25(29)21-13-7-9-17-8-2-3-12-20(17)21/h2-16H,1H3,(H,26,29)(H,27,28)
InChIKeyKXGHYBAPGJIUGU-UHFFFAOYSA-N
XLogP5.35
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.45
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-bromobenzoyl)amino]-N-(2-methoxyphenyl)benzamide
CID 52644751
2-[[3-[(2-methoxybenzoyl)amino]benzoyl]amino]benzoic acid
CID 17341336
3-anilino-N-(2-methoxyphenyl)benzamide
CID 3501279
ethyl N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]carbamate
CID 17415342
4-methoxy-3-(naphthalene-1-carbonylamino)benzoic acid
CID 28668454
N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide
CID 66596351
2-[(3-methoxybenzoyl)amino]-N-(3-methoxyphenyl)benzamide
CID 51154923
1-N-(3,4-difluorophenyl)-3-N-(2-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057618
3-(2,2-dimethylpropanoylamino)-N-naphthalen-1-ylbenzamide
CID 35186877
3,4,5-trimethoxy-N-[2-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 990875
2-[[3-[(2-ethoxybenzoyl)amino]benzoyl]amino]benzoic acid
CID 2204072
N-(2-ethoxyphenyl)-3-[(2-naphthalen-1-yloxyacetyl)amino]benzamide
CID 11841398

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide?
The IUPAC name of N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide (CID 34636649) is N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide is COc1ccccc1NC(=O)c1cccc(NC(=O)c2cccc3ccccc23)c1.
What is the InChIKey of N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide?
The InChIKey is KXGHYBAPGJIUGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2O3/c1-30-23-15-5-4-14-22(23)27-24(28)18-10-6-11-19(16-18)26-25(29)21-13-7-9-17-8-2-3-12-20(17)21/h2-16H,1H3,(H,26,29)(H,27,28).
What are the key properties of N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide?
N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide has a molecular weight of 396.45 g/mol, XLogP of 5.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide is sourced from PubChem (CID 34636649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).