N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride

C15H25ClN2O2 — CID 119664956

IUPACN-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride
SMILESCCCCC(CN)NC(=O)c1ccc(C)c(OC)c1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-4-5-6-13(10-16)17-15(18)12-8-7-11(2)14(9-12)19-3;/h7-9,13H,4-6,10,16H2,1-3H3,(H,17,18);1H
InChIKeyFGKMIPFPRQISEM-UHFFFAOYSA-N
MW300.83 g/mol
LogP2.67
Rot. Bonds7

About N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride

N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride (PubChem CID 119664956) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride
PubChem CID119664956
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC NameN-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride
SMILESCCCCC(CN)NC(=O)c1ccc(C)c(OC)c1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-4-5-6-13(10-16)17-15(18)12-8-7-11(2)14(9-12)19-3;/h7-9,13H,4-6,10,16H2,1-3H3,(H,17,18);1H
InChIKeyFGKMIPFPRQISEM-UHFFFAOYSA-N
XLogP2.67
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.83
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminohexan-2-yl)-3-methoxy-4-(2-methylpropoxy)benzamide;hydrochloride
CID 119666426
N-(1-aminohexan-2-yl)-3-(difluoromethoxy)-4-methoxybenzamide
CID 119666149
N-(1-amino-4-methylpentan-2-yl)-4-butoxy-3-methoxybenzamide;hydrochloride
CID 119587214
N-(1-aminohexan-2-yl)-4-chloro-3-methylbenzamide
CID 113265964
N-[(2S)-1-aminopropan-2-yl]-3-methoxy-4-methylbenzamide
CID 120507834
N-(1-aminohexan-2-yl)-3-methylbenzamide;hydrochloride
CID 119667380
N-(1-aminohexan-2-yl)-3-(cyclopentylsulfamoyl)-4-methoxybenzamide;hydrochloride
CID 119665887
N-(1-aminohexan-2-yl)-3-bromo-4-fluorobenzamide;hydrochloride
CID 119668140
N-(1-aminohexan-2-yl)-3-(methanesulfonamido)-4,5-dimethoxybenzamide;hydrochloride
CID 119665737
N-(1-aminohexan-2-yl)-3-(diethylsulfamoyl)-4-methylbenzamide
CID 119668137
N-(1-aminohexan-2-yl)-3,5-dimethylbenzamide
CID 80697654
3-N-(1-aminohexan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide;hydrochloride
CID 119668834

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride (CID 119664956) is N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride is CCCCC(CN)NC(=O)c1ccc(C)c(OC)c1.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride?
The InChIKey is FGKMIPFPRQISEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-4-5-6-13(10-16)17-15(18)12-8-7-11(2)14(9-12)19-3;/h7-9,13H,4-6,10,16H2,1-3H3,(H,17,18);1H.
What are the key properties of N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride?
N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 2.67, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-3-methoxy-4-methylbenzamide;hydrochloride is sourced from PubChem (CID 119664956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).