5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide

C16H16ClNO3 — CID 11841436

IUPAC5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide
SMILESCOc1ccc(Cl)cc1C(=O)Nc1cccc(C(C)O)c1
InChIInChI=1S/C16H16ClNO3/c1-10(19)11-4-3-5-13(8-11)18-16(20)14-9-12(17)6-7-15(14)21-2/h3-10,19H,1-2H3,(H,18,20)
InChIKeyDWFFJKDSXXUYOK-UHFFFAOYSA-N
MW305.76 g/mol
LogP3.65
Rot. Bonds4

About 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide

5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide (PubChem CID 11841436) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide
PubChem CID11841436
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC Name5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide
SMILESCOc1ccc(Cl)cc1C(=O)Nc1cccc(C(C)O)c1
InChIInChI=1S/C16H16ClNO3/c1-10(19)11-4-3-5-13(8-11)18-16(20)14-9-12(17)6-7-15(14)21-2/h3-10,19H,1-2H3,(H,18,20)
InChIKeyDWFFJKDSXXUYOK-UHFFFAOYSA-N
XLogP3.65
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 91676947
N-[3-(aminomethyl)phenyl]-5-chloro-2-methoxybenzamide
CID 63254170
3-chloro-N-[3-[(1S)-1-hydroxyethyl]phenyl]benzamide
CID 27209859
5-chloro-N-(3,4-difluorophenyl)-2-methoxybenzamide
CID 842280
N-(3-amino-4-methoxyphenyl)-5-chloro-2-methoxybenzamide
CID 43599928
5-chloro-N-[4-chloro-2-[hydroxy(phenyl)methyl]phenyl]-2-methoxybenzamide
CID 50882360
4-chloro-2-fluoro-N-(3-propan-2-ylphenyl)benzamide
CID 27162860
2-chloro-N-(3-chlorophenyl)-3-methoxybenzamide
CID 45051393
N-(4-bromo-3-methylphenyl)-5-chloro-2-methoxybenzamide
CID 2198688
4-amino-2-chloro-N-[3-[(1S)-1-hydroxyethyl]phenyl]benzamide
CID 100803624
5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide
CID 17111377
5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide?
The IUPAC name of 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide (CID 11841436) is 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide.
What is the SMILES notation for 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide?
The canonical SMILES for 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide is COc1ccc(Cl)cc1C(=O)Nc1cccc(C(C)O)c1.
What is the InChIKey of 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide?
The InChIKey is DWFFJKDSXXUYOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-10(19)11-4-3-5-13(8-11)18-16(20)14-9-12(17)6-7-15(14)21-2/h3-10,19H,1-2H3,(H,18,20).
What are the key properties of 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide?
5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide has a molecular weight of 305.76 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide is sourced from PubChem (CID 11841436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).