1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide

C23H18N2O2 — CID 135879308

IUPAC1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide
SMILESCc1ccc(/N=C2/C(C(=O)Nc3ccccc3)=C(O)c3ccccc32)cc1
InChIInChI=1S/C23H18N2O2/c1-15-11-13-17(14-12-15)24-21-18-9-5-6-10-19(18)22(26)20(21)23(27)25-16-7-3-2-4-8-16/h2-14,26H,1H3,(H,25,27)/b24-21+
InChIKeyVNWWEXHCVQUPJM-DARPEHSRSA-N
MW354.41 g/mol
LogP5.04
Rot. Bonds3

About 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide

1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide (PubChem CID 135879308) has the molecular formula C23H18N2O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide.

Molecular Properties

Compound Name1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide
PubChem CID135879308
Molecular FormulaC23H18N2O2
Molecular Weight354.41 g/mol
Exact Mass354.14
IUPAC Name1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide
SMILESCc1ccc(/N=C2/C(C(=O)Nc3ccccc3)=C(O)c3ccccc32)cc1
InChIInChI=1S/C23H18N2O2/c1-15-11-13-17(14-12-15)24-21-18-9-5-6-10-19(18)22(26)20(21)23(27)25-16-7-3-2-4-8-16/h2-14,26H,1H3,(H,25,27)/b24-21+
InChIKeyVNWWEXHCVQUPJM-DARPEHSRSA-N
XLogP5.04
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.41
LogP ≤ 55.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-[(4-methylphenyl)carbamoylamino]-N-phenylbenzamide
CID 143832330
4-[(7-chloro-2-oxo-1H-indol-3-ylidene)amino]-N-(4-methylphenyl)benzamide
CID 135559471
1-[4-[(2-oxo-1H-indol-3-ylidene)amino]phenyl]-3-phenylurea
CID 135995901
5-methyl-2-(4-methylphenyl)-N-phenylbenzamide
CID 173213744
N-phenylacetamide;toluene
CID 175205531
N'-(fluoren-9-ylideneamino)-N-(4-methylphenyl)oxamide
CID 9155525
2,5-bis(4-methylphenyl)-3-N,4-N-diphenylfuran-3,4-dicarboxamide
CID 10576901
ethane;N-phenyl-4-phenyldiazenylbenzamide
CID 159586308
2,3,4,5,6-pentamethyl-N-phenylbenzamide
CID 60629319
2-[(4-methylbenzoyl)amino]-N-phenylbenzamide
CID 913419
2,2-difluoro-2-(4-methylphenyl)-N-phenylacetamide
CID 102584725
2,5-dihydroxy-1-N,4-N-bis(3-methylphenyl)-3,6-dioxocyclohexa-1,4-diene-1,4-dicarboxamide
CID 98096567

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide?
The IUPAC name of 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide (CID 135879308) is 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide.
What is the SMILES notation for 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide?
The canonical SMILES for 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide is Cc1ccc(/N=C2/C(C(=O)Nc3ccccc3)=C(O)c3ccccc32)cc1.
What is the InChIKey of 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide?
The InChIKey is VNWWEXHCVQUPJM-DARPEHSRSA-N. The full InChI is InChI=1S/C23H18N2O2/c1-15-11-13-17(14-12-15)24-21-18-9-5-6-10-19(18)22(26)20(21)23(27)25-16-7-3-2-4-8-16/h2-14,26H,1H3,(H,25,27)/b24-21+.
What are the key properties of 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide?
1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 5.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3-(4-methylphenyl)imino-N-phenylindene-2-carboxamide is sourced from PubChem (CID 135879308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).