N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide

C16H14N2O2 — CID 107799235

IUPACN-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide
SMILESCc1cccc(NC(=O)Cc2ccccc2O)c1C#N
InChIInChI=1S/C16H14N2O2/c1-11-5-4-7-14(13(11)10-17)18-16(20)9-12-6-2-3-8-15(12)19/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyKISPQCUKYMAVGB-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.75
Rot. Bonds3

About N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide

N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide (PubChem CID 107799235) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide
PubChem CID107799235
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC NameN-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide
SMILESCc1cccc(NC(=O)Cc2ccccc2O)c1C#N
InChIInChI=1S/C16H14N2O2/c1-11-5-4-7-14(13(11)10-17)18-16(20)9-12-6-2-3-8-15(12)19/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyKISPQCUKYMAVGB-UHFFFAOYSA-N
XLogP2.75
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyano-3-fluorophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80740497
N-(2-cyano-3-methylphenyl)-2-(methylamino)acetamide
CID 107804985
N-(2-cyanophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80740419
2-[(2-cyano-3-methylphenyl)carbamoylamino]acetic acid
CID 107799973
N-(2-cyano-3-methylphenyl)-5-hydroxypentanamide
CID 107801603
1-(2-cyano-3-methylphenyl)-3-ethylurea
CID 103710079
N-(2-cyano-3-methylphenyl)-2-(prop-2-ynylamino)acetamide
CID 114003133
N-(2-cyano-3-methylphenyl)-2-(cyclopropylamino)acetamide
CID 107805022
2-(2-methylphenyl)-N-[2-[[2-(2-methylphenyl)acetyl]amino]phenyl]acetamide
CID 26164464
N-(2-cyano-3-methylphenyl)-3-hydroxy-2-methylbenzamide
CID 107799224
2-(2-cyano-3-methylanilino)-2-oxoacetic acid
CID 12715815
2-amino-N-(2-cyano-3-methylphenyl)propanamide
CID 107804990

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide (CID 107799235) is N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide is Cc1cccc(NC(=O)Cc2ccccc2O)c1C#N.
What is the InChIKey of N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide?
The InChIKey is KISPQCUKYMAVGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-11-5-4-7-14(13(11)10-17)18-16(20)9-12-6-2-3-8-15(12)19/h2-8,19H,9H2,1H3,(H,18,20).
What are the key properties of N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide?
N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide has a molecular weight of 266.30 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-3-methylphenyl)-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 107799235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).