4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide

C26H22N2O2 — CID 4940825

IUPAC4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide
SMILESCCN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1cccc2ccccc12
InChIInChI=1S/C26H22N2O2/c1-2-28(24-14-8-12-19-9-6-7-13-23(19)24)26(30)21-15-17-22(18-16-21)27-25(29)20-10-4-3-5-11-20/h3-18H,2H2,1H3,(H,27,29)
InChIKeyVPQNJUAHYQAJPN-UHFFFAOYSA-N
MW394.47 g/mol
LogP5.76
Rot. Bonds5

About 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide

4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide (PubChem CID 4940825) has the molecular formula C26H22N2O2 and a molecular weight of 394.47 g/mol. Its IUPAC name is 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide.

Molecular Properties

Compound Name4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide
PubChem CID4940825
Molecular FormulaC26H22N2O2
Molecular Weight394.47 g/mol
Exact Mass394.17
IUPAC Name4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide
SMILESCCN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1cccc2ccccc12
InChIInChI=1S/C26H22N2O2/c1-2-28(24-14-8-12-19-9-6-7-13-23(19)24)26(30)21-15-17-22(18-16-21)27-25(29)20-10-4-3-5-11-20/h3-18H,2H2,1H3,(H,27,29)
InChIKeyVPQNJUAHYQAJPN-UHFFFAOYSA-N
XLogP5.76
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.47
LogP ≤ 55.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-4-[(4-methoxybenzoyl)amino]-N-naphthalen-1-ylbenzamide
CID 4940850
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
N-[4-[ethyl(naphthalen-1-yl)carbamoyl]phenyl]-3,4,5-trimethoxybenzamide
CID 4940863
4-[4-[ethyl(naphthalen-1-yl)carbamoyl]anilino]-4-oxobut-2-enoic acid
CID 4940775
3-butan-2-yloxy-N-[4-[ethyl(naphthalen-1-yl)carbamoyl]phenyl]benzamide
CID 43878417
N-[4-[ethyl(naphthalen-1-yl)carbamoyl]phenyl]-3-iodo-4-methoxybenzamide
CID 4940853
4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide
CID 55592158
N-ethyl-4-[[2-(2-methylphenyl)acetyl]amino]-N-naphthalen-1-ylbenzamide
CID 26169011
ethyl 3-[4-[ethyl(naphthalen-1-yl)carbamoyl]anilino]-3-oxopropanoate
CID 26168945
4-N-ethyl-1-N,4-N-diphenylbenzene-1,4-dicarboxamide
CID 109049216
4-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]-N-ethyl-N-naphthalen-1-ylbenzamide
CID 6234760

Frequently Asked Questions

What is the IUPAC name of 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide?
The IUPAC name of 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide (CID 4940825) is 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide.
What is the SMILES notation for 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide?
The canonical SMILES for 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide is CCN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1cccc2ccccc12.
What is the InChIKey of 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide?
The InChIKey is VPQNJUAHYQAJPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O2/c1-2-28(24-14-8-12-19-9-6-7-13-23(19)24)26(30)21-15-17-22(18-16-21)27-25(29)20-10-4-3-5-11-20/h3-18H,2H2,1H3,(H,27,29).
What are the key properties of 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide?
4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide has a molecular weight of 394.47 g/mol, XLogP of 5.76, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzamido-N-ethyl-N-naphthalen-1-ylbenzamide is sourced from PubChem (CID 4940825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).