2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide

C14H18ClNO2 — CID 167898094

IUPAC2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide
SMILESCN(C(=O)c1c(O)cccc1Cl)C1(C)CCCC1
InChIInChI=1S/C14H18ClNO2/c1-14(8-3-4-9-14)16(2)13(18)12-10(15)6-5-7-11(12)17/h5-7,17H,3-4,8-9H2,1-2H3
InChIKeyKWTFLEZCMKDXFV-UHFFFAOYSA-N
MW267.76 g/mol
LogP3.45
Rot. Bonds2

About 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide

2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide (PubChem CID 167898094) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide.

Molecular Properties

Compound Name2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide
PubChem CID167898094
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide
SMILESCN(C(=O)c1c(O)cccc1Cl)C1(C)CCCC1
InChIInChI=1S/C14H18ClNO2/c1-14(8-3-4-9-14)16(2)13(18)12-10(15)6-5-7-11(12)17/h5-7,17H,3-4,8-9H2,1-2H3
InChIKeyKWTFLEZCMKDXFV-UHFFFAOYSA-N
XLogP3.45
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(1-methylcyclopropyl)benzamide
CID 66675854
2-chloro-6-fluoro-N-[(1-hydroxycyclopentyl)methyl]-N-methylbenzamide
CID 115759842
2,6-dichloro-N-[(1-hydroxycyclopentyl)methyl]benzamide
CID 65113651
2-chloro-N-(2-chlorocyclohexyl)-6-fluoro-N-methylbenzamide
CID 102637966
2-chloro-6-[[1-(dimethylamino)cyclopentyl]methylamino]benzoic acid
CID 83118194
2-(2,6-dichlorophenyl)-1-[1-(dimethylamino)cycloheptyl]ethanone
CID 79063235
methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate
CID 43422763
1-(2-chloro-6-hydroxyphenyl)butan-1-one
CID 130034391
1-[2-chloro-6-(dimethylamino)phenyl]cyclohexane-1-carboxylic acid
CID 117452732
1-[(2-chlorophenyl)methyl]-N-methyl-N-(1-methylcyclobutyl)-6-oxopyridine-3-carboxamide
CID 166315489
(2-chlorophenyl)-(1-methylcyclohexyl)methanone
CID 22173260
2,6-dichloro-N,N-dicyclohexylbenzamide
CID 3555098

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide?
The IUPAC name of 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide (CID 167898094) is 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide.
What is the SMILES notation for 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide?
The canonical SMILES for 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide is CN(C(=O)c1c(O)cccc1Cl)C1(C)CCCC1.
What is the InChIKey of 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide?
The InChIKey is KWTFLEZCMKDXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c1-14(8-3-4-9-14)16(2)13(18)12-10(15)6-5-7-11(12)17/h5-7,17H,3-4,8-9H2,1-2H3.
What are the key properties of 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide?
2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide has a molecular weight of 267.76 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-hydroxy-N-methyl-N-(1-methylcyclopentyl)benzamide is sourced from PubChem (CID 167898094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).