3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide

C15H16N2O2 — CID 43694119

IUPAC3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide
SMILESCc1c(NCc2cccc(O)c2)cccc1C(N)=O
InChIInChI=1S/C15H16N2O2/c1-10-13(15(16)19)6-3-7-14(10)17-9-11-4-2-5-12(18)8-11/h2-8,17-18H,9H2,1H3,(H2,16,19)
InChIKeyQXSCMYSZGLYTII-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.41
Rot. Bonds4

About 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide

3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide (PubChem CID 43694119) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide.

Molecular Properties

Compound Name3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide
PubChem CID43694119
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide
SMILESCc1c(NCc2cccc(O)c2)cccc1C(N)=O
InChIInChI=1S/C15H16N2O2/c1-10-13(15(16)19)6-3-7-14(10)17-9-11-4-2-5-12(18)8-11/h2-8,17-18H,9H2,1H3,(H2,16,19)
InChIKeyQXSCMYSZGLYTII-UHFFFAOYSA-N
XLogP2.41
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-hydroxyphenyl)methylamino]-N,2-dimethylbenzamide
CID 43734564
3-[[3-(difluoromethyl)phenyl]methylamino]-2-methylbenzoic acid
CID 115526266
3-[(3-chloro-2-hydroxyphenyl)methylamino]-2-methylbenzamide
CID 115904226
3-(3,3-dimethylbutylamino)-2-methylbenzamide
CID 62952099
2-methyl-3-[(5-methylthiophen-2-yl)methylamino]benzamide
CID 43694008
ethyl 3-(benzylamino)-2-methylbenzoate
CID 5127212
3-[(3-methoxyphenyl)methylamino]-2-methylbenzoic acid
CID 17059607
5-[(3-carbamoyl-2-methylanilino)methyl]thiophene-3-carboxamide
CID 79614087
3-[(3-methoxy-2,4-dimethylanilino)methyl]phenol
CID 43739022
3-(heptylamino)-2-methylbenzamide
CID 43694125
3-[(3-aminothiophen-2-yl)methylamino]-2-methylbenzamide
CID 66385546
2-methyl-3-(1,3-thiazol-5-ylmethylamino)benzamide
CID 62758134

Frequently Asked Questions

What is the IUPAC name of 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide?
The IUPAC name of 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide (CID 43694119) is 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide.
What is the SMILES notation for 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide?
The canonical SMILES for 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide is Cc1c(NCc2cccc(O)c2)cccc1C(N)=O.
What is the InChIKey of 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide?
The InChIKey is QXSCMYSZGLYTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-13(15(16)19)6-3-7-14(10)17-9-11-4-2-5-12(18)8-11/h2-8,17-18H,9H2,1H3,(H2,16,19).
What are the key properties of 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide?
3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide has a molecular weight of 256.31 g/mol, XLogP of 2.41, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide is sourced from PubChem (CID 43694119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).