2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine

C15H29N — CID 107188288

IUPAC2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine
SMILESCNC(CC1CCCCC1)C1CCCC1C
InChIInChI=1S/C15H29N/c1-12-7-6-10-14(12)15(16-2)11-13-8-4-3-5-9-13/h12-16H,3-11H2,1-2H3
InChIKeyIZBFFUNAGARMRO-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.98
Rot. Bonds4

About 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine

2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine (PubChem CID 107188288) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine
PubChem CID107188288
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine
SMILESCNC(CC1CCCCC1)C1CCCC1C
InChIInChI=1S/C15H29N/c1-12-7-6-10-14(12)15(16-2)11-13-8-4-3-5-9-13/h12-16H,3-11H2,1-2H3
InChIKeyIZBFFUNAGARMRO-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
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 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine?
The IUPAC name of 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine (CID 107188288) is 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine?
The canonical SMILES for 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine is CNC(CC1CCCCC1)C1CCCC1C.
What is the InChIKey of 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine?
The InChIKey is IZBFFUNAGARMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-12-7-6-10-14(12)15(16-2)11-13-8-4-3-5-9-13/h12-16H,3-11H2,1-2H3.
What are the key properties of 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine?
2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine has a molecular weight of 223.40 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine is sourced from PubChem (CID 107188288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).