4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride

C14H20Cl2N2O2 — CID 119670043

IUPAC4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride
SMILESCOc1cc(N)c(Cl)cc1C(=O)NC1CCCCC1.Cl
InChIInChI=1S/C14H19ClN2O2.ClH/c1-19-13-8-12(16)11(15)7-10(13)14(18)17-9-5-3-2-4-6-9;/h7-9H,2-6,16H2,1H3,(H,17,18);1H
InChIKeyJLQJJFQCSRKMOR-UHFFFAOYSA-N
MW319.23 g/mol
LogP3.42
Rot. Bonds3

About 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride

4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride (PubChem CID 119670043) has the molecular formula C14H20Cl2N2O2 and a molecular weight of 319.23 g/mol. Its IUPAC name is 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride.

Molecular Properties

Compound Name4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride
PubChem CID119670043
Molecular FormulaC14H20Cl2N2O2
Molecular Weight319.23 g/mol
Exact Mass318.09
IUPAC Name4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride
SMILESCOc1cc(N)c(Cl)cc1C(=O)NC1CCCCC1.Cl
InChIInChI=1S/C14H19ClN2O2.ClH/c1-19-13-8-12(16)11(15)7-10(13)14(18)17-9-5-3-2-4-6-9;/h7-9H,2-6,16H2,1H3,(H,17,18);1H
InChIKeyJLQJJFQCSRKMOR-UHFFFAOYSA-N
XLogP3.42
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.23
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-amino-5-chloro-N-(3-ethylcyclohexyl)-2-methoxybenzamide;hydrochloride
CID 119793328
N-cyclooctyl-2,4,5-trimethoxybenzamide
CID 912719
4-amino-5-chloro-2-methoxy-N-[4-(trifluoromethyl)cyclohexyl]benzamide
CID 119701825
4-amino-5-chloro-2-methoxy-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)benzamide;dihydrochloride
CID 119892106
N-cyclohexyl-2,5-dimethoxy-4-methylbenzamide
CID 110763218
[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl] 4-amino-5-chloro-2-methoxybenzoate
CID 7414191
4-amino-N-(1-benzhydrylpiperidin-4-yl)-5-chloro-2-methoxybenzamide;hydrochloride
CID 3044767
4-amino-N-(1-benzylpiperidin-4-yl)-5-chloro-2-methoxybenzamide;dihydrochloride
CID 119827622
4-amino-5-chloro-2-methoxy-N-(2,3,5,8-tetrahydro-1H-pyrazolo[1,2-a]pyridazin-2-yl)benzamide
CID 13121444
4-amino-5-chloro-N-(2-cyclohexyl-2-hydroxyethyl)-2-methoxybenzamide
CID 119731737
2-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]butanoic acid
CID 22080716
4-amino-5-chloro-N-(3-cyclohexyloxypropyl)-2-methoxybenzamide
CID 119693448

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride?
The IUPAC name of 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride (CID 119670043) is 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride.
What is the SMILES notation for 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride?
The canonical SMILES for 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride is COc1cc(N)c(Cl)cc1C(=O)NC1CCCCC1.Cl.
What is the InChIKey of 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride?
The InChIKey is JLQJJFQCSRKMOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2.ClH/c1-19-13-8-12(16)11(15)7-10(13)14(18)17-9-5-3-2-4-6-9;/h7-9H,2-6,16H2,1H3,(H,17,18);1H.
What are the key properties of 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride?
4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride has a molecular weight of 319.23 g/mol, XLogP of 3.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-chloro-N-cyclohexyl-2-methoxybenzamide;hydrochloride is sourced from PubChem (CID 119670043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).