1-cyclohexyl-N-propylhexan-3-amine

C15H31N — CID 63400154

IUPAC1-cyclohexyl-N-propylhexan-3-amine
SMILESCCCNC(CCC)CCC1CCCCC1
InChIInChI=1S/C15H31N/c1-3-8-15(16-13-4-2)12-11-14-9-6-5-7-10-14/h14-16H,3-13H2,1-2H3
InChIKeyWRYKRIUGONWTGH-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.52
Rot. Bonds8

About 1-cyclohexyl-N-propylhexan-3-amine

1-cyclohexyl-N-propylhexan-3-amine (PubChem CID 63400154) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 1-cyclohexyl-N-propylhexan-3-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-propylhexan-3-amine
PubChem CID63400154
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name1-cyclohexyl-N-propylhexan-3-amine
SMILESCCCNC(CCC)CCC1CCCCC1
InChIInChI=1S/C15H31N/c1-3-8-15(16-13-4-2)12-11-14-9-6-5-7-10-14/h14-16H,3-13H2,1-2H3
InChIKeyWRYKRIUGONWTGH-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine
CID 115863549
1-cyclohexyl-6,6-dimethyl-N-propylheptan-3-amine
CID 115849970
4-cyclohexyl-1-(oxan-4-yl)-N-propylbutan-2-amine
CID 115846851
1-cyclohexyl-N-propylpentan-2-amine
CID 63413972
1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine
CID 104992726
4-cyclohexyl-1-ethoxy-N-propylbutan-2-amine
CID 105008032
1-cyclohexyl-6-methoxy-6-methyl-N-propylheptan-3-amine
CID 103031953
1-cycloheptyl-5-methyl-N-propylhexan-2-amine
CID 115834105
N-(3-cyclopentylpropyl)hexan-3-amine
CID 106008928
1-cyclohexyl-4-methyl-N-propylpentan-3-amine
CID 63399865
1-(cyclopentylmethylsulfanyl)-N-propylpentan-2-amine
CID 64627212
3-cyclopentyl-1-cyclopropyl-N-propylpropan-1-amine
CID 63354880

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-propylhexan-3-amine?
The IUPAC name of 1-cyclohexyl-N-propylhexan-3-amine (CID 63400154) is 1-cyclohexyl-N-propylhexan-3-amine.
What is the SMILES notation for 1-cyclohexyl-N-propylhexan-3-amine?
The canonical SMILES for 1-cyclohexyl-N-propylhexan-3-amine is CCCNC(CCC)CCC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-propylhexan-3-amine?
The InChIKey is WRYKRIUGONWTGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-3-8-15(16-13-4-2)12-11-14-9-6-5-7-10-14/h14-16H,3-13H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-propylhexan-3-amine?
1-cyclohexyl-N-propylhexan-3-amine has a molecular weight of 225.42 g/mol, XLogP of 4.52, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-propylhexan-3-amine is sourced from PubChem (CID 63400154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).