4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide

C15H14ClNO3 — CID 64794839

IUPAC4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide
SMILESCOc1cc(Cl)ccc1C(=O)Nc1ccc(CO)cc1
InChIInChI=1S/C15H14ClNO3/c1-20-14-8-11(16)4-7-13(14)15(19)17-12-5-2-10(9-18)3-6-12/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyCYWUUGXFZULNOW-UHFFFAOYSA-N
MW291.73 g/mol
LogP3.09
Rot. Bonds4

About 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide

4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide (PubChem CID 64794839) has the molecular formula C15H14ClNO3 and a molecular weight of 291.73 g/mol. Its IUPAC name is 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide.

Molecular Properties

Compound Name4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide
PubChem CID64794839
Molecular FormulaC15H14ClNO3
Molecular Weight291.73 g/mol
Exact Mass291.07
IUPAC Name4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide
SMILESCOc1cc(Cl)ccc1C(=O)Nc1ccc(CO)cc1
InChIInChI=1S/C15H14ClNO3/c1-20-14-8-11(16)4-7-13(14)15(19)17-12-5-2-10(9-18)3-6-12/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyCYWUUGXFZULNOW-UHFFFAOYSA-N
XLogP3.09
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.73
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(4-iodophenyl)-2-methoxybenzamide
CID 47421842
4-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide
CID 82880967
N-(4-butylphenyl)-5-chloro-2-methoxybenzamide
CID 3544721
4-chloro-N-[2-(chloromethyl)phenyl]-2-methoxybenzamide
CID 114298257
4-chloro-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 47449992
4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide
CID 60594030
N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide
CID 17314016
N-(4-chlorophenyl)-2,3,4-trimethoxybenzamide
CID 4794471
N-[4-(hydroxymethyl)phenyl]-3-methoxy-4-methylbenzamide
CID 64793166
4-chloro-2-methoxy-N-[(4-propan-2-ylphenyl)methyl]benzamide
CID 71822149
N-(3-chloro-4-fluorophenyl)-2,4-dimethoxybenzamide
CID 4674672
4-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 29278893

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide?
The IUPAC name of 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide (CID 64794839) is 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide.
What is the SMILES notation for 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide?
The canonical SMILES for 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide is COc1cc(Cl)ccc1C(=O)Nc1ccc(CO)cc1.
What is the InChIKey of 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide?
The InChIKey is CYWUUGXFZULNOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO3/c1-20-14-8-11(16)4-7-13(14)15(19)17-12-5-2-10(9-18)3-6-12/h2-8,18H,9H2,1H3,(H,17,19).
What are the key properties of 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide?
4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide has a molecular weight of 291.73 g/mol, XLogP of 3.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[4-(hydroxymethyl)phenyl]-2-methoxybenzamide is sourced from PubChem (CID 64794839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).