4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide

C14H18ClNO2 — CID 61217012

IUPAC4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide
SMILESCC1(NC(=O)c2ccc(Cl)cc2O)CCCCC1
InChIInChI=1S/C14H18ClNO2/c1-14(7-3-2-4-8-14)16-13(18)11-6-5-10(15)9-12(11)17/h5-6,9,17H,2-4,7-8H2,1H3,(H,16,18)
InChIKeyWEMKXJMZYWKEDS-UHFFFAOYSA-N
MW267.76 g/mol
LogP3.50
Rot. Bonds2

About 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide

4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide (PubChem CID 61217012) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide.

Molecular Properties

Compound Name4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide
PubChem CID61217012
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide
SMILESCC1(NC(=O)c2ccc(Cl)cc2O)CCCCC1
InChIInChI=1S/C14H18ClNO2/c1-14(7-3-2-4-8-14)16-13(18)11-6-5-10(15)9-12(11)17/h5-6,9,17H,2-4,7-8H2,1H3,(H,16,18)
InChIKeyWEMKXJMZYWKEDS-UHFFFAOYSA-N
XLogP3.50
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide?
The IUPAC name of 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide (CID 61217012) is 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide.
What is the SMILES notation for 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide?
The canonical SMILES for 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide is CC1(NC(=O)c2ccc(Cl)cc2O)CCCCC1.
What is the InChIKey of 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide?
The InChIKey is WEMKXJMZYWKEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c1-14(7-3-2-4-8-14)16-13(18)11-6-5-10(15)9-12(11)17/h5-6,9,17H,2-4,7-8H2,1H3,(H,16,18).
What are the key properties of 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide?
4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide has a molecular weight of 267.76 g/mol, XLogP of 3.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide is sourced from PubChem (CID 61217012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).