1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine

C16H31N — CID 65399795

IUPAC1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine
SMILESCNC(C1CCCCCC1)C1CCCC(C)C1
InChIInChI=1S/C16H31N/c1-13-8-7-11-15(12-13)16(17-2)14-9-5-3-4-6-10-14/h13-17H,3-12H2,1-2H3
InChIKeyXQIIKWLTBAALKE-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.37
Rot. Bonds3

About 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine

1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine (PubChem CID 65399795) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine.

Molecular Properties

Compound Name1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine
PubChem CID65399795
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine
SMILESCNC(C1CCCCCC1)C1CCCC(C)C1
InChIInChI=1S/C16H31N/c1-13-8-7-11-15(12-13)16(17-2)14-9-5-3-4-6-10-14/h13-17H,3-12H2,1-2H3
InChIKeyXQIIKWLTBAALKE-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4,4-dimethylcyclohexyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 65390833
1-(4-ethylcyclohexyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 64774419
1-(6-bicyclo[3.1.0]hexanyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 104991901
1-cycloheptyl-1-cyclopropyl-N-methylmethanamine
CID 65399883
1-(2,2-dimethylcyclopropyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 107004571
[cyclobutyl-(3-methylcyclohexyl)methyl]hydrazine
CID 105210413
N-[cyclopentyl-(3-methylcyclohexyl)methyl]ethanamine
CID 63415340
1-cyclobutyl-1-(3,4-dimethylcyclohexyl)-N-methylmethanamine
CID 64986980
1-(4-ethylcyclohexyl)-N-methyl-1-(3-methylcyclopentyl)methanamine
CID 65413158
N-[di(cyclobutyl)methyl]-3-methylcyclohexan-1-amine
CID 112743180
1-cycloheptyl-N-methyl-1-(oxan-4-yl)methanamine
CID 65399325
1-(3,5-dimethylcyclohexyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65423221

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine?
The IUPAC name of 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine (CID 65399795) is 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine.
What is the SMILES notation for 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine?
The canonical SMILES for 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine is CNC(C1CCCCCC1)C1CCCC(C)C1.
What is the InChIKey of 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine?
The InChIKey is XQIIKWLTBAALKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-13-8-7-11-15(12-13)16(17-2)14-9-5-3-4-6-10-14/h13-17H,3-12H2,1-2H3.
What are the key properties of 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine?
1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine has a molecular weight of 237.43 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine is sourced from PubChem (CID 65399795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).