2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine

C16H33N — CID 114192486

IUPAC2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine
SMILESCCCC(CCC1CCCCC1)CNC(C)C
InChIInChI=1S/C16H33N/c1-4-8-16(13-17-14(2)3)12-11-15-9-6-5-7-10-15/h14-17H,4-13H2,1-3H3
InChIKeyJAVBMJQTMAYAMM-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.76
Rot. Bonds8

About 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine

2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine (PubChem CID 114192486) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine.

Molecular Properties

Compound Name2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine
PubChem CID114192486
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC Name2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine
SMILESCCCC(CCC1CCCCC1)CNC(C)C
InChIInChI=1S/C16H33N/c1-4-8-16(13-17-14(2)3)12-11-15-9-6-5-7-10-15/h14-17H,4-13H2,1-3H3
InChIKeyJAVBMJQTMAYAMM-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.45
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethylhexylcyclopentane
CID 123372890
2,4-dicyclopentyl-N-propan-2-ylbutan-1-amine
CID 114192567
1-cyclopentyl-N-ethyl-4-methylheptan-3-amine
CID 107893474
1-cyclohexyl-N-propylhexan-3-amine
CID 63400154
3-[(propan-2-ylamino)methyl]hexan-1-ol
CID 103921662
N-propan-2-yl-2-propylheptan-1-amine
CID 62529127
1-cyclohexyl-4-methyl-N-propylpentan-3-amine
CID 63399865
1-cyclohexylhexan-3-amine
CID 43370456
2-(cyclohexylmethyl)-N-(2-methylpropyl)pentan-1-amine
CID 55196028
2-(2-methoxyethyl)-N-propan-2-ylpentan-1-amine
CID 62529731
N-propan-2-yl-2-(4-propylpiperidin-1-yl)propan-1-amine
CID 62439844
[4-methylsulfanyl-3-(methylsulfanylmethyl)butyl]cyclohexane
CID 23432666

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine?
The IUPAC name of 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine (CID 114192486) is 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine.
What is the SMILES notation for 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine?
The canonical SMILES for 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine is CCCC(CCC1CCCCC1)CNC(C)C.
What is the InChIKey of 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine?
The InChIKey is JAVBMJQTMAYAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-4-8-16(13-17-14(2)3)12-11-15-9-6-5-7-10-15/h14-17H,4-13H2,1-3H3.
What are the key properties of 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine?
2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine has a molecular weight of 239.45 g/mol, XLogP of 4.76, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexylethyl)-N-propan-2-ylpentan-1-amine is sourced from PubChem (CID 114192486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).