N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine

C15H23N — CID 82127246

IUPACN-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine
SMILESCNC1(Cc2cccc(C)c2)CCCCC1
InChIInChI=1S/C15H23N/c1-13-7-6-8-14(11-13)12-15(16-2)9-4-3-5-10-15/h6-8,11,16H,3-5,9-10,12H2,1-2H3
InChIKeyGRCMCCWFJGNBTF-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.46
Rot. Bonds3

About N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine

N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine (PubChem CID 82127246) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine
PubChem CID82127246
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine
SMILESCNC1(Cc2cccc(C)c2)CCCCC1
InChIInChI=1S/C15H23N/c1-13-7-6-8-14(11-13)12-15(16-2)9-4-3-5-10-15/h6-8,11,16H,3-5,9-10,12H2,1-2H3
InChIKeyGRCMCCWFJGNBTF-UHFFFAOYSA-N
XLogP3.46
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(3-chlorophenyl)methyl]-N-methylcyclopentan-1-amine
CID 82128067
1-[(3-methoxyphenyl)methyl]-N-methylcyclohexan-1-amine
CID 82129111
N-methyl-1-[1-[(3-methylphenyl)methyl]cyclopentyl]methanamine
CID 62724183
1-[(3,4-dichlorophenyl)methyl]-N-methylcyclohexan-1-amine
CID 94697451
1-[(3-methylphenyl)methyl]cyclopropan-1-amine
CID 23106077
2-[1-(methylamino)cyclohexyl]-N-(3-methylphenyl)acetamide
CID 65240773
N-ethyl-3-methyl-N-[2-[1-(methylamino)cyclohexyl]ethyl]aniline
CID 65241281
1-methyl-N-[(3-methylphenyl)methyl]cyclopropan-1-amine
CID 115635136
1-(1-methoxycycloheptyl)-N-methyl-2-(3-methylphenyl)ethanamine
CID 116770183
5-(methylaminomethyl)-N-[1-[(3-methylphenyl)methyl]cyclopropyl]-1,3,4-oxadiazol-2-amine
CID 137335056
methyl 1-[(3-methylphenyl)methyl]cyclopropane-1-carboxylate
CID 116929872
1-[(benzylamino)methyl]-N-methylcyclohexan-1-amine
CID 130573796

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine?
The IUPAC name of N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine (CID 82127246) is N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine?
The canonical SMILES for N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine is CNC1(Cc2cccc(C)c2)CCCCC1.
What is the InChIKey of N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine?
The InChIKey is GRCMCCWFJGNBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-13-7-6-8-14(11-13)12-15(16-2)9-4-3-5-10-15/h6-8,11,16H,3-5,9-10,12H2,1-2H3.
What are the key properties of N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine?
N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(3-methylphenyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 82127246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).