2-cyclohexylpropan-2-amine

C9H19N — CID 22376970

IUPAC2-cyclohexylpropan-2-amine
SMILESCC(C)(N)C1CCCCC1
InChIInChI=1S/C9H19N/c1-9(2,10)8-6-4-3-5-7-8/h8H,3-7,10H2,1-2H3
InChIKeyLBAHQPMPKGDCDV-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.30
Rot. Bonds1

About 2-cyclohexylpropan-2-amine

2-cyclohexylpropan-2-amine (PubChem CID 22376970) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 2-cyclohexylpropan-2-amine.

Molecular Properties

Compound Name2-cyclohexylpropan-2-amine
PubChem CID22376970
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name2-cyclohexylpropan-2-amine
SMILESCC(C)(N)C1CCCCC1
InChIInChI=1S/C9H19N/c1-9(2,10)8-6-4-3-5-7-8/h8H,3-7,10H2,1-2H3
InChIKeyLBAHQPMPKGDCDV-UHFFFAOYSA-N
XLogP2.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylpropan-2-amine?
The IUPAC name of 2-cyclohexylpropan-2-amine (CID 22376970) is 2-cyclohexylpropan-2-amine.
What is the SMILES notation for 2-cyclohexylpropan-2-amine?
The canonical SMILES for 2-cyclohexylpropan-2-amine is CC(C)(N)C1CCCCC1.
What is the InChIKey of 2-cyclohexylpropan-2-amine?
The InChIKey is LBAHQPMPKGDCDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-9(2,10)8-6-4-3-5-7-8/h8H,3-7,10H2,1-2H3.
What are the key properties of 2-cyclohexylpropan-2-amine?
2-cyclohexylpropan-2-amine has a molecular weight of 141.26 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylpropan-2-amine is sourced from PubChem (CID 22376970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).