5-cyclohexyl-N,N,3-trimethylhexan-1-amine

C15H31N — CID 23577153

IUPAC5-cyclohexyl-N,N,3-trimethylhexan-1-amine
SMILESCC(CCN(C)C)CC(C)C1CCCCC1
InChIInChI=1S/C15H31N/c1-13(10-11-16(3)4)12-14(2)15-8-6-5-7-9-15/h13-15H,5-12H2,1-4H3
InChIKeyJAJNVUMEPDIMJZ-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.18
Rot. Bonds6

About 5-cyclohexyl-N,N,3-trimethylhexan-1-amine

5-cyclohexyl-N,N,3-trimethylhexan-1-amine (PubChem CID 23577153) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 5-cyclohexyl-N,N,3-trimethylhexan-1-amine.

Molecular Properties

Compound Name5-cyclohexyl-N,N,3-trimethylhexan-1-amine
PubChem CID23577153
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name5-cyclohexyl-N,N,3-trimethylhexan-1-amine
SMILESCC(CCN(C)C)CC(C)C1CCCCC1
InChIInChI=1S/C15H31N/c1-13(10-11-16(3)4)12-14(2)15-8-6-5-7-9-15/h13-15H,5-12H2,1-4H3
InChIKeyJAJNVUMEPDIMJZ-UHFFFAOYSA-N
XLogP4.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-N,N,3-trimethylhexan-1-amine?
The IUPAC name of 5-cyclohexyl-N,N,3-trimethylhexan-1-amine (CID 23577153) is 5-cyclohexyl-N,N,3-trimethylhexan-1-amine.
What is the SMILES notation for 5-cyclohexyl-N,N,3-trimethylhexan-1-amine?
The canonical SMILES for 5-cyclohexyl-N,N,3-trimethylhexan-1-amine is CC(CCN(C)C)CC(C)C1CCCCC1.
What is the InChIKey of 5-cyclohexyl-N,N,3-trimethylhexan-1-amine?
The InChIKey is JAJNVUMEPDIMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-13(10-11-16(3)4)12-14(2)15-8-6-5-7-9-15/h13-15H,5-12H2,1-4H3.
What are the key properties of 5-cyclohexyl-N,N,3-trimethylhexan-1-amine?
5-cyclohexyl-N,N,3-trimethylhexan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.18, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-N,N,3-trimethylhexan-1-amine is sourced from PubChem (CID 23577153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).