5-cyclohexyl-N,N-dimethylpentan-1-amine

C13H27N — CID 18790234

IUPAC5-cyclohexyl-N,N-dimethylpentan-1-amine
SMILESCN(C)CCCCCC1CCCCC1
InChIInChI=1S/C13H27N/c1-14(2)12-8-4-7-11-13-9-5-3-6-10-13/h13H,3-12H2,1-2H3
InChIKeyGELRCLKVOPWJBW-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.69
Rot. Bonds6

About 5-cyclohexyl-N,N-dimethylpentan-1-amine

5-cyclohexyl-N,N-dimethylpentan-1-amine (PubChem CID 18790234) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is 5-cyclohexyl-N,N-dimethylpentan-1-amine.

Molecular Properties

Compound Name5-cyclohexyl-N,N-dimethylpentan-1-amine
PubChem CID18790234
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC Name5-cyclohexyl-N,N-dimethylpentan-1-amine
SMILESCN(C)CCCCCC1CCCCC1
InChIInChI=1S/C13H27N/c1-14(2)12-8-4-7-11-13-9-5-3-6-10-13/h13H,3-12H2,1-2H3
InChIKeyGELRCLKVOPWJBW-UHFFFAOYSA-N
XLogP3.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-N,N-dimethylpentan-1-amine?
The IUPAC name of 5-cyclohexyl-N,N-dimethylpentan-1-amine (CID 18790234) is 5-cyclohexyl-N,N-dimethylpentan-1-amine.
What is the SMILES notation for 5-cyclohexyl-N,N-dimethylpentan-1-amine?
The canonical SMILES for 5-cyclohexyl-N,N-dimethylpentan-1-amine is CN(C)CCCCCC1CCCCC1.
What is the InChIKey of 5-cyclohexyl-N,N-dimethylpentan-1-amine?
The InChIKey is GELRCLKVOPWJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-14(2)12-8-4-7-11-13-9-5-3-6-10-13/h13H,3-12H2,1-2H3.
What are the key properties of 5-cyclohexyl-N,N-dimethylpentan-1-amine?
5-cyclohexyl-N,N-dimethylpentan-1-amine has a molecular weight of 197.37 g/mol, XLogP of 3.69, 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-dimethylpentan-1-amine is sourced from PubChem (CID 18790234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).