3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide

C16H17NO2 — CID 62313945

IUPAC3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide
SMILESCc1cccc(CCNC(=O)c2cccc(O)c2)c1
InChIInChI=1S/C16H17NO2/c1-12-4-2-5-13(10-12)8-9-17-16(19)14-6-3-7-15(18)11-14/h2-7,10-11,18H,8-9H2,1H3,(H,17,19)
InChIKeyQGWFECIEHDWKLB-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.67
Rot. Bonds4

About 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide

3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide (PubChem CID 62313945) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide
PubChem CID62313945
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide
SMILESCc1cccc(CCNC(=O)c2cccc(O)c2)c1
InChIInChI=1S/C16H17NO2/c1-12-4-2-5-13(10-12)8-9-17-16(19)14-6-3-7-15(18)11-14/h2-7,10-11,18H,8-9H2,1H3,(H,17,19)
InChIKeyQGWFECIEHDWKLB-UHFFFAOYSA-N
XLogP2.67
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(chloromethyl)-N-[2-(3-methylphenyl)ethyl]benzamide
CID 62314649
3-amino-N-[2-(3-methylphenyl)ethyl]benzamide
CID 62313883
4-hydroxy-3-methyl-N-[2-(3-methylphenyl)ethyl]benzamide
CID 103951860
N-[2-(3,4-dihydroxyphenyl)ethyl]-3-methylbenzamide
CID 78796412
4-bromo-3-fluoro-N-[2-(3-methylphenyl)ethyl]benzamide
CID 60611411
6-fluoro-N-[2-(3-methylphenyl)ethyl]pyridine-3-carboxamide
CID 63978992
6-amino-N-[2-(3-methylphenyl)ethyl]pyridine-3-carboxamide
CID 62313054
2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide
CID 86967702
3-methyl-N-[2-(4-methylsulfonylphenyl)ethyl]benzamide
CID 110790612
N-(2-bromoethyl)-3-hydroxybenzamide
CID 114307478
N-[2-(3-hydroxyphenyl)ethyl]-6-methylpyridine-2-carboxamide
CID 110483053
2-bromo-N-[2-(3-methylphenyl)ethyl]benzamide
CID 62315224

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide?
The IUPAC name of 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide (CID 62313945) is 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide.
What is the SMILES notation for 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide?
The canonical SMILES for 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide is Cc1cccc(CCNC(=O)c2cccc(O)c2)c1.
What is the InChIKey of 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide?
The InChIKey is QGWFECIEHDWKLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12-4-2-5-13(10-12)8-9-17-16(19)14-6-3-7-15(18)11-14/h2-7,10-11,18H,8-9H2,1H3,(H,17,19).
What are the key properties of 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide?
3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide has a molecular weight of 255.32 g/mol, XLogP of 2.67, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 62313945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).