4,4-diethylcyclohexan-1-amine

C10H21N — CID 15719641

IUPAC4,4-diethylcyclohexan-1-amine
SMILESCCC1(CC)CCC(N)CC1
InChIInChI=1S/C10H21N/c1-3-10(4-2)7-5-9(11)6-8-10/h9H,3-8,11H2,1-2H3
InChIKeyNAYGFGSBOKLOAY-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.69
Rot. Bonds2

About 4,4-diethylcyclohexan-1-amine

4,4-diethylcyclohexan-1-amine (PubChem CID 15719641) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 4,4-diethylcyclohexan-1-amine.

Molecular Properties

Compound Name4,4-diethylcyclohexan-1-amine
PubChem CID15719641
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name4,4-diethylcyclohexan-1-amine
SMILESCCC1(CC)CCC(N)CC1
InChIInChI=1S/C10H21N/c1-3-10(4-2)7-5-9(11)6-8-10/h9H,3-8,11H2,1-2H3
InChIKeyNAYGFGSBOKLOAY-UHFFFAOYSA-N
XLogP2.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,4-diethylcyclohexan-1-amine?
The IUPAC name of 4,4-diethylcyclohexan-1-amine (CID 15719641) is 4,4-diethylcyclohexan-1-amine.
What is the SMILES notation for 4,4-diethylcyclohexan-1-amine?
The canonical SMILES for 4,4-diethylcyclohexan-1-amine is CCC1(CC)CCC(N)CC1.
What is the InChIKey of 4,4-diethylcyclohexan-1-amine?
The InChIKey is NAYGFGSBOKLOAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-3-10(4-2)7-5-9(11)6-8-10/h9H,3-8,11H2,1-2H3.
What are the key properties of 4,4-diethylcyclohexan-1-amine?
4,4-diethylcyclohexan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diethylcyclohexan-1-amine is sourced from PubChem (CID 15719641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).