N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide

C25H19ClN2O3 — CID 2268765

IUPACN-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl
InChIInChI=1S/C25H19ClN2O3/c1-31-23-15-17-8-6-5-7-16(17)13-20(23)25(30)28-22-14-18(11-12-21(22)26)24(29)27-19-9-3-2-4-10-19/h2-15H,1H3,(H,27,29)(H,28,30)
InChIKeyARFKKGGMKRVLQY-UHFFFAOYSA-N
MW430.89 g/mol
LogP6.01
Rot. Bonds5

About N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide

N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide (PubChem CID 2268765) has the molecular formula C25H19ClN2O3 and a molecular weight of 430.89 g/mol. Its IUPAC name is N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide
PubChem CID2268765
Molecular FormulaC25H19ClN2O3
Molecular Weight430.89 g/mol
Exact Mass430.11
IUPAC NameN-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl
InChIInChI=1S/C25H19ClN2O3/c1-31-23-15-17-8-6-5-7-16(17)13-20(23)25(30)28-22-14-18(11-12-21(22)26)24(29)27-19-9-3-2-4-10-19/h2-15H,1H3,(H,27,29)(H,28,30)
InChIKeyARFKKGGMKRVLQY-UHFFFAOYSA-N
XLogP6.01
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.89
LogP ≤ 56.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-chloro-3-[(3-methoxynaphthalene-2-carbonyl)amino]benzoate
CID 92679714
N-[2-chloro-5-(phenylcarbamoyl)phenyl]-2-methylquinoline-3-carboxamide
CID 86982673
6-methoxy-7-(phenylcarbamoyl)naphthalene-2-carboxylic acid
CID 23118707
dimethyl 5-[(3-methoxynaphthalene-2-carbonyl)amino]benzene-1,3-dicarboxylate
CID 1378947
N-[2-chloro-5-(phenylcarbamoyl)phenyl]-2,3,4,5,6-pentamethylbenzamide
CID 2250223
N-[4-chloro-3-(trifluoromethyl)phenyl]-3-methoxynaphthalene-2-carboxamide
CID 7930859
methyl 4-chloro-3-[(2-methoxybenzoyl)amino]benzoate
CID 926199
N-(3-fluorophenyl)-3-methoxynaphthalene-2-carboxamide
CID 802408
4-chloro-3-(3,3-diphenylpropanoylamino)-N-(4-methoxyphenyl)benzamide
CID 11839612
3-methoxy-N-[5-[(3-methoxynaphthalene-2-carbonyl)amino]naphthalen-1-yl]naphthalene-2-carboxamide
CID 5082580
N-(2-amino-4-chlorophenyl)-3-methoxynaphthalene-2-carboxamide
CID 91687381
N-[3-(ethylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide
CID 17439182

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide?
The IUPAC name of N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide (CID 2268765) is N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide.
What is the SMILES notation for N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide?
The canonical SMILES for N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl.
What is the InChIKey of N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide?
The InChIKey is ARFKKGGMKRVLQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19ClN2O3/c1-31-23-15-17-8-6-5-7-16(17)13-20(23)25(30)28-22-14-18(11-12-21(22)26)24(29)27-19-9-3-2-4-10-19/h2-15H,1H3,(H,27,29)(H,28,30).
What are the key properties of N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide?
N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide has a molecular weight of 430.89 g/mol, XLogP of 6.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide is sourced from PubChem (CID 2268765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).