3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine

C18H35N — CID 104989179

IUPAC3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine
SMILESCNC(CCC1CCCCC1)C1CCC(C)C(C)C1
InChIInChI=1S/C18H35N/c1-14-9-11-17(13-15(14)2)18(19-3)12-10-16-7-5-4-6-8-16/h14-19H,4-13H2,1-3H3
InChIKeyJGPBIYBLZSGQHG-UHFFFAOYSA-N
MW265.48 g/mol
LogP5.01
Rot. Bonds5

About 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine

3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine (PubChem CID 104989179) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine
PubChem CID104989179
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC Name3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine
SMILESCNC(CCC1CCCCC1)C1CCC(C)C(C)C1
InChIInChI=1S/C18H35N/c1-14-9-11-17(13-15(14)2)18(19-3)12-10-16-7-5-4-6-8-16/h14-19H,4-13H2,1-3H3
InChIKeyJGPBIYBLZSGQHG-UHFFFAOYSA-N
XLogP5.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-ethylethanamine
CID 104989257
1-[3-(2-cycloheptylethyl)cyclohexyl]-N-methylbutan-1-amine
CID 170003941
[3-cyclohexyl-1-(4-methylcyclohexyl)propyl]hydrazine
CID 105311822
1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine
CID 105154410
1-(3,4-dimethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
CID 103559423
3-cycloheptyl-1-cyclopropyl-N-ethylpropan-1-amine
CID 82924608
[2-cyclopropyl-1-(3,4-dimethylcyclohexyl)ethyl]hydrazine
CID 105254136
3-cyclohexyl-N-methyl-1-(3-methyloxan-4-yl)propan-1-amine
CID 114242028
2-cyclohexyl-1-cyclopropyl-N-methylethanamine
CID 62600401
1-(3,4-dimethylcyclohexyl)-4-methoxy-N,3-dimethylbutan-1-amine
CID 105154616
1-(2-bicyclo[2.2.1]heptanyl)-3-cyclopentyl-N-methylpropan-1-amine
CID 114192236
4-cyclopentyl-N-methylbutan-2-amine
CID 61343208

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine?
The IUPAC name of 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine (CID 104989179) is 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine is CNC(CCC1CCCCC1)C1CCC(C)C(C)C1.
What is the InChIKey of 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine?
The InChIKey is JGPBIYBLZSGQHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-14-9-11-17(13-15(14)2)18(19-3)12-10-16-7-5-4-6-8-16/h14-19H,4-13H2,1-3H3.
What are the key properties of 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine?
3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine has a molecular weight of 265.48 g/mol, XLogP of 5.01, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine is sourced from PubChem (CID 104989179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).