N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide

C27H24N2O3 — CID 4940850

IUPACN-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide
SMILESCCN(C(=O)c1ccc(NC(=O)c2ccc(OC)cc2)cc1)c1cccc2ccccc12
InChIInChI=1S/C27H24N2O3/c1-3-29(25-10-6-8-19-7-4-5-9-24(19)25)27(31)21-11-15-22(16-12-21)28-26(30)20-13-17-23(32-2)18-14-20/h4-18H,3H2,1-2H3,(H,28,30)
InChIKeyCSSLBZCHXVNYRW-UHFFFAOYSA-N
MW424.50 g/mol
LogP5.77
Rot. Bonds6

About N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide

N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide (PubChem CID 4940850) has the molecular formula C27H24N2O3 and a molecular weight of 424.50 g/mol. Its IUPAC name is N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide.

Molecular Properties

Compound NameN-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide
PubChem CID4940850
Molecular FormulaC27H24N2O3
Molecular Weight424.50 g/mol
Exact Mass424.18
IUPAC NameN-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide
SMILESCCN(C(=O)c1ccc(NC(=O)c2ccc(OC)cc2)cc1)c1cccc2ccccc12
InChIInChI=1S/C27H24N2O3/c1-3-29(25-10-6-8-19-7-4-5-9-24(19)25)27(31)21-11-15-22(16-12-21)28-26(30)20-13-17-23(32-2)18-14-20/h4-18H,3H2,1-2H3,(H,28,30)
InChIKeyCSSLBZCHXVNYRW-UHFFFAOYSA-N
XLogP5.77
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.50
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide
CID 4940825
N-[4-[ethyl(naphthalen-1-yl)carbamoyl]phenyl]-3,4,5-trimethoxybenzamide
CID 4940863
N-ethyl-4-[3-(4-methoxyphenyl)prop-2-enoylamino]-N-naphthalen-1-ylbenzamide
CID 4940910
N-[4-[ethyl(naphthalen-1-yl)carbamoyl]phenyl]-3-iodo-4-methoxybenzamide
CID 4940853
3-butan-2-yloxy-N-[4-[ethyl(naphthalen-1-yl)carbamoyl]phenyl]benzamide
CID 43878417
4-[(2,2-diphenylacetyl)amino]-N-ethyl-N-naphthalen-1-ylbenzamide
CID 4940823
N-[4-[ethyl(naphthalen-1-yl)carbamoyl]phenyl]-3-nitrobenzamide
CID 4940815
ethyl 3-[4-[ethyl(naphthalen-1-yl)carbamoyl]anilino]-3-oxopropanoate
CID 26168945
4-[4-[ethyl(naphthalen-1-yl)carbamoyl]anilino]-4-oxobut-2-enoic acid
CID 4940775
N-ethyl-4-[[2-(2-methylphenyl)acetyl]amino]-N-naphthalen-1-ylbenzamide
CID 26169011
N-(2-aminophenyl)-N-ethyl-4-methoxybenzamide
CID 62101473
4-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-ethyl-N-naphthalen-1-ylbenzamide
CID 4940764

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide?
The IUPAC name of N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide (CID 4940850) is N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide.
What is the SMILES notation for N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide?
The canonical SMILES for N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide is CCN(C(=O)c1ccc(NC(=O)c2ccc(OC)cc2)cc1)c1cccc2ccccc12.
What is the InChIKey of N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide?
The InChIKey is CSSLBZCHXVNYRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N2O3/c1-3-29(25-10-6-8-19-7-4-5-9-24(19)25)27(31)21-11-15-22(16-12-21)28-26(30)20-13-17-23(32-2)18-14-20/h4-18H,3H2,1-2H3,(H,28,30).
What are the key properties of N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide?
N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide has a molecular weight of 424.50 g/mol, XLogP of 5.77, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide is sourced from PubChem (CID 4940850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).