2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine

C16H31N — CID 64765709

IUPAC2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine
SMILESCC1CCC(C(C)(C)CC2CCCC2)C(N)C1
InChIInChI=1S/C16H31N/c1-12-8-9-14(15(17)10-12)16(2,3)11-13-6-4-5-7-13/h12-15H,4-11,17H2,1-3H3
InChIKeyJYAZKZYPLLFDOU-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.36
Rot. Bonds3

About 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine

2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine (PubChem CID 64765709) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine
PubChem CID64765709
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine
SMILESCC1CCC(C(C)(C)CC2CCCC2)C(N)C1
InChIInChI=1S/C16H31N/c1-12-8-9-14(15(17)10-12)16(2,3)11-13-6-4-5-7-13/h12-15H,4-11,17H2,1-3H3
InChIKeyJYAZKZYPLLFDOU-UHFFFAOYSA-N
XLogP4.36
TPSA26.02 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 ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine?
The IUPAC name of 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine (CID 64765709) is 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine.
What is the SMILES notation for 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine?
The canonical SMILES for 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine is CC1CCC(C(C)(C)CC2CCCC2)C(N)C1.
What is the InChIKey of 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine?
The InChIKey is JYAZKZYPLLFDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-12-8-9-14(15(17)10-12)16(2,3)11-13-6-4-5-7-13/h12-15H,4-11,17H2,1-3H3.
What are the key properties of 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine?
2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 4.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine is sourced from PubChem (CID 64765709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).