N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride

C21H27ClN2O2 — CID 119478339

IUPACN-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride
SMILESCc1ccccc1COc1ccccc1C(=O)NC1CCC(N)CC1.Cl
InChIInChI=1S/C21H26N2O2.ClH/c1-15-6-2-3-7-16(15)14-25-20-9-5-4-8-19(20)21(24)23-18-12-10-17(22)11-13-18;/h2-9,17-18H,10-14,22H2,1H3,(H,23,24);1H
InChIKeyACIILFVAQQJXKO-UHFFFAOYSA-N
MW374.91 g/mol
LogP4.00
Rot. Bonds5

About N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride

N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride (PubChem CID 119478339) has the molecular formula C21H27ClN2O2 and a molecular weight of 374.91 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride
PubChem CID119478339
Molecular FormulaC21H27ClN2O2
Molecular Weight374.91 g/mol
Exact Mass374.18
IUPAC NameN-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride
SMILESCc1ccccc1COc1ccccc1C(=O)NC1CCC(N)CC1.Cl
InChIInChI=1S/C21H26N2O2.ClH/c1-15-6-2-3-7-16(15)14-25-20-9-5-4-8-19(20)21(24)23-18-12-10-17(22)11-13-18;/h2-9,17-18H,10-14,22H2,1H3,(H,23,24);1H
InChIKeyACIILFVAQQJXKO-UHFFFAOYSA-N
XLogP4.00
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.91
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methylphenyl)methoxy]-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119453556
N-(4-aminocyclohexyl)-2-prop-2-enoxybenzamide;hydrochloride
CID 119478882
N-(4-aminocyclohexyl)-2-methylbenzamide
CID 43653114
N-(2-amino-1-cyclopropylethyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride
CID 119616996
2-[(2-methylphenyl)methoxy]benzamide
CID 7642222
N-cyclopropyl-2-methylbenzamide;hydrochloride
CID 162767207
2-[(2-bromophenyl)methoxy]-N-(1-methylpiperidin-4-yl)benzamide
CID 55857067
N-[4-[(4-aminocyclohexyl)amino]-4-oxobutyl]-2-ethoxybenzamide;hydrochloride
CID 119476321
2-[(2-methylphenyl)methoxy]-N-(piperidin-3-ylmethyl)benzamide
CID 119463848
2-methoxy-N-[4-[(2-methoxybenzoyl)amino]cyclohexyl]benzamide
CID 1235931
N-(4-hydroxycyclohexyl)-2-[(3-methylphenyl)methoxy]benzamide
CID 24982275
N-cyclopentyl-2-[[2-(2-methylphenyl)acetyl]amino]benzamide
CID 17476217

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride?
The IUPAC name of N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride (CID 119478339) is N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride?
The canonical SMILES for N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride is Cc1ccccc1COc1ccccc1C(=O)NC1CCC(N)CC1.Cl.
What is the InChIKey of N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride?
The InChIKey is ACIILFVAQQJXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2.ClH/c1-15-6-2-3-7-16(15)14-25-20-9-5-4-8-19(20)21(24)23-18-12-10-17(22)11-13-18;/h2-9,17-18H,10-14,22H2,1H3,(H,23,24);1H.
What are the key properties of N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride?
N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride has a molecular weight of 374.91 g/mol, XLogP of 4.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride is sourced from PubChem (CID 119478339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).