N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride

C15H22ClNO3 — CID 67897205

IUPACN-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride
SMILESCOc1ccc(C(=O)NC2CCCCC2)cc1OC.Cl
InChIInChI=1S/C15H21NO3.ClH/c1-18-13-9-8-11(10-14(13)19-2)15(17)16-12-6-4-3-5-7-12;/h8-10,12H,3-7H2,1-2H3,(H,16,17);1H
InChIKeyAVBZLWVXJINQKX-UHFFFAOYSA-N
MW299.80 g/mol
LogP3.19
Rot. Bonds4

About N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride

N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride (PubChem CID 67897205) has the molecular formula C15H22ClNO3 and a molecular weight of 299.80 g/mol. Its IUPAC name is N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride.

Molecular Properties

Compound NameN-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride
PubChem CID67897205
Molecular FormulaC15H22ClNO3
Molecular Weight299.80 g/mol
Exact Mass299.13
IUPAC NameN-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride
SMILESCOc1ccc(C(=O)NC2CCCCC2)cc1OC.Cl
InChIInChI=1S/C15H21NO3.ClH/c1-18-13-9-8-11(10-14(13)19-2)15(17)16-12-6-4-3-5-7-12;/h8-10,12H,3-7H2,1-2H3,(H,16,17);1H
InChIKeyAVBZLWVXJINQKX-UHFFFAOYSA-N
XLogP3.19
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-3-ethoxy-4-methoxybenzamide
CID 2992515
N-cycloheptyl-3-ethoxy-4-methoxybenzamide
CID 24539374
N-cyclohexyl-3-hydroxy-4-methoxybenzamide
CID 79600190
3-chloro-N-cyclohexyl-4-methoxybenzamide
CID 56923251
N-(4-bromocyclohexyl)-3,4-dimethoxybenzamide
CID 114309034
N-cyclopentyl-4-iodo-3-methoxybenzamide
CID 155908716
N-cyclopentyl-4-fluoro-3-methoxybenzamide
CID 80948074
N-cyclobutyl-4-methoxy-3-methylbenzamide
CID 121342416
5-(cyclohexylcarbamoyl)-2-methoxybenzenesulfonyl chloride
CID 65366957
N-cyclohexyl-4-methoxy-3-sulfamoylbenzamide
CID 60635033
N-cyclohexyl-4-methoxy-3-nitrobenzamide
CID 711599
N-cyclooctyl-3,4,5-trimethoxybenzamide
CID 679003

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride?
The IUPAC name of N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride (CID 67897205) is N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride.
What is the SMILES notation for N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride?
The canonical SMILES for N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride is COc1ccc(C(=O)NC2CCCCC2)cc1OC.Cl.
What is the InChIKey of N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride?
The InChIKey is AVBZLWVXJINQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3.ClH/c1-18-13-9-8-11(10-14(13)19-2)15(17)16-12-6-4-3-5-7-12;/h8-10,12H,3-7H2,1-2H3,(H,16,17);1H.
What are the key properties of N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride?
N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride has a molecular weight of 299.80 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride is sourced from PubChem (CID 67897205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).