2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide

C14H18ClNO2 — CID 107418935

IUPAC2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide
SMILESCC1CCCC1CNC(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C14H18ClNO2/c1-9-3-2-4-10(9)8-16-14(18)12-7-11(17)5-6-13(12)15/h5-7,9-10,17H,2-4,8H2,1H3,(H,16,18)
InChIKeyDXODARBHEMQBCL-UHFFFAOYSA-N
MW267.76 g/mol
LogP3.21
Rot. Bonds3

About 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide

2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide (PubChem CID 107418935) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide.

Molecular Properties

Compound Name2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide
PubChem CID107418935
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide
SMILESCC1CCCC1CNC(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C14H18ClNO2/c1-9-3-2-4-10(9)8-16-14(18)12-7-11(17)5-6-13(12)15/h5-7,9-10,17H,2-4,8H2,1H3,(H,16,18)
InChIKeyDXODARBHEMQBCL-UHFFFAOYSA-N
XLogP3.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-5-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
CID 106502468
2-chloro-N-[(2-methylcyclopentyl)methyl]-4-nitrobenzamide
CID 107417795
5-fluoro-2-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107418921
2-amino-5-chloro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 55013606
5-amino-2,3-dichloro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 107184871
4-chloro-6-methyl-N-[(2-methylcyclohexyl)methyl]pyridine-3-carboxamide
CID 81227209
N-[[2-(chloromethyl)cyclohexyl]methyl]-2,5-dihydroxybenzamide
CID 107725996
2-chloro-N-[(1,1-dioxothiolan-2-yl)methyl]-5-hydroxybenzamide
CID 106502019
4,5-difluoro-2-[(2-methylcyclopentyl)methylcarbamoyl]benzoic acid
CID 107416687
N-[(2-bromocyclopentyl)methyl]-2,5-dihydroxybenzamide
CID 107726047
2-(methylamino)-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107419522
3-amino-2-chloro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 112575789

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide?
The IUPAC name of 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide (CID 107418935) is 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide.
What is the SMILES notation for 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide?
The canonical SMILES for 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide is CC1CCCC1CNC(=O)c1cc(O)ccc1Cl.
What is the InChIKey of 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide?
The InChIKey is DXODARBHEMQBCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c1-9-3-2-4-10(9)8-16-14(18)12-7-11(17)5-6-13(12)15/h5-7,9-10,17H,2-4,8H2,1H3,(H,16,18).
What are the key properties of 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide?
2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide has a molecular weight of 267.76 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide is sourced from PubChem (CID 107418935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).