1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine

C15H29N — CID 107187738

IUPAC1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine
SMILESCNC(C1CCCCC1)C1CCCC1(C)C
InChIInChI=1S/C15H29N/c1-15(2)11-7-10-13(15)14(16-3)12-8-5-4-6-9-12/h12-14,16H,4-11H2,1-3H3
InChIKeyUMQHCJREHCFQPZ-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.98
Rot. Bonds3

About 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine

1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine (PubChem CID 107187738) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine
PubChem CID107187738
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine
SMILESCNC(C1CCCCC1)C1CCCC1(C)C
InChIInChI=1S/C15H29N/c1-15(2)11-7-10-13(15)14(16-3)12-8-5-4-6-9-12/h12-14,16H,4-11H2,1-3H3
InChIKeyUMQHCJREHCFQPZ-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine?
The IUPAC name of 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine (CID 107187738) is 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine?
The canonical SMILES for 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine is CNC(C1CCCCC1)C1CCCC1(C)C.
What is the InChIKey of 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine?
The InChIKey is UMQHCJREHCFQPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-15(2)11-7-10-13(15)14(16-3)12-8-5-4-6-9-12/h12-14,16H,4-11H2,1-3H3.
What are the key properties of 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine?
1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine has a molecular weight of 223.40 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-(2,2-dimethylcyclopentyl)-N-methylmethanamine is sourced from PubChem (CID 107187738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).