2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide

C15H16N2O3 — CID 175971606

IUPAC2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide
SMILESCOc1cccc(NCc2ccc(C(N)=O)c(O)c2)c1
InChIInChI=1S/C15H16N2O3/c1-20-12-4-2-3-11(8-12)17-9-10-5-6-13(15(16)19)14(18)7-10/h2-8,17-18H,9H2,1H3,(H2,16,19)
InChIKeyNEWOTFUITQABJH-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.11
Rot. Bonds5

About 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide

2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide (PubChem CID 175971606) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide
PubChem CID175971606
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide
SMILESCOc1cccc(NCc2ccc(C(N)=O)c(O)c2)c1
InChIInChI=1S/C15H16N2O3/c1-20-12-4-2-3-11(8-12)17-9-10-5-6-13(15(16)19)14(18)7-10/h2-8,17-18H,9H2,1H3,(H2,16,19)
InChIKeyNEWOTFUITQABJH-UHFFFAOYSA-N
XLogP2.11
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-(anilinomethyl)-2-hydroxybenzamide
CID 175971604
2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide
CID 43720165
2-chloro-5-[(3-hydroxy-4-methoxyphenyl)methylamino]benzamide
CID 43713494
N-[(4-iodophenyl)methyl]-3-methoxyaniline
CID 65478997
3-(3-methoxyanilino)propanamide
CID 43131962
N-[(3-chloro-4-methoxyphenyl)methyl]-3-methoxyaniline
CID 65022380
N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide
CID 28661894
3-[(3-methoxyphenyl)methylamino]-N-methylbenzamide
CID 28650224
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303
N-[(3-chloro-4-fluorophenyl)methyl]-3-methoxyaniline
CID 81144109
N-(2-aminophenyl)-4-[(3-methoxyanilino)methyl]benzamide
CID 22478895
2-chloro-4-[(2-hydroxy-4-methoxyphenyl)methylamino]benzamide
CID 61261202

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide?
The IUPAC name of 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide (CID 175971606) is 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide.
What is the SMILES notation for 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide?
The canonical SMILES for 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide is COc1cccc(NCc2ccc(C(N)=O)c(O)c2)c1.
What is the InChIKey of 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide?
The InChIKey is NEWOTFUITQABJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-20-12-4-2-3-11(8-12)17-9-10-5-6-13(15(16)19)14(18)7-10/h2-8,17-18H,9H2,1H3,(H2,16,19).
What are the key properties of 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide?
2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide has a molecular weight of 272.30 g/mol, XLogP of 2.11, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-[(3-methoxyanilino)methyl]benzamide is sourced from PubChem (CID 175971606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).