1,3,3,5,5-pentamethylcyclohexan-1-amine

C11H23N — CID 6433106

IUPAC1,3,3,5,5-pentamethylcyclohexan-1-amine
SMILESCC1(C)CC(C)(C)CC(C)(N)C1
InChIInChI=1S/C11H23N/c1-9(2)6-10(3,4)8-11(5,12)7-9/h6-8,12H2,1-5H3
InChIKeyOGZQTTHDGQBLBT-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.94
Rot. Bonds

About 1,3,3,5,5-pentamethylcyclohexan-1-amine

1,3,3,5,5-pentamethylcyclohexan-1-amine (PubChem CID 6433106) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 1,3,3,5,5-pentamethylcyclohexan-1-amine.

Molecular Properties

Compound Name1,3,3,5,5-pentamethylcyclohexan-1-amine
PubChem CID6433106
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name1,3,3,5,5-pentamethylcyclohexan-1-amine
SMILESCC1(C)CC(C)(C)CC(C)(N)C1
InChIInChI=1S/C11H23N/c1-9(2)6-10(3,4)8-11(5,12)7-9/h6-8,12H2,1-5H3
InChIKeyOGZQTTHDGQBLBT-UHFFFAOYSA-N
XLogP2.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,3,3,5,5-pentamethylcyclohexan-1-amine?
The IUPAC name of 1,3,3,5,5-pentamethylcyclohexan-1-amine (CID 6433106) is 1,3,3,5,5-pentamethylcyclohexan-1-amine.
What is the SMILES notation for 1,3,3,5,5-pentamethylcyclohexan-1-amine?
The canonical SMILES for 1,3,3,5,5-pentamethylcyclohexan-1-amine is CC1(C)CC(C)(C)CC(C)(N)C1.
What is the InChIKey of 1,3,3,5,5-pentamethylcyclohexan-1-amine?
The InChIKey is OGZQTTHDGQBLBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-9(2)6-10(3,4)8-11(5,12)7-9/h6-8,12H2,1-5H3.
What are the key properties of 1,3,3,5,5-pentamethylcyclohexan-1-amine?
1,3,3,5,5-pentamethylcyclohexan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.94, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3,5,5-pentamethylcyclohexan-1-amine is sourced from PubChem (CID 6433106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).