2-(2-ethylcyclohexyl)-3-methylpentan-2-amine

C14H29N — CID 63861635

IUPAC2-(2-ethylcyclohexyl)-3-methylpentan-2-amine
SMILESCCC1CCCCC1C(C)(N)C(C)CC
InChIInChI=1S/C14H29N/c1-5-11(3)14(4,15)13-10-8-7-9-12(13)6-2/h11-13H,5-10,15H2,1-4H3
InChIKeyHPOYEGLJPFPTBJ-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.97
Rot. Bonds4

About 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine

2-(2-ethylcyclohexyl)-3-methylpentan-2-amine (PubChem CID 63861635) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine.

Molecular Properties

Compound Name2-(2-ethylcyclohexyl)-3-methylpentan-2-amine
PubChem CID63861635
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name2-(2-ethylcyclohexyl)-3-methylpentan-2-amine
SMILESCCC1CCCCC1C(C)(N)C(C)CC
InChIInChI=1S/C14H29N/c1-5-11(3)14(4,15)13-10-8-7-9-12(13)6-2/h11-13H,5-10,15H2,1-4H3
InChIKeyHPOYEGLJPFPTBJ-UHFFFAOYSA-N
XLogP3.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine?
The IUPAC name of 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine (CID 63861635) is 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine.
What is the SMILES notation for 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine?
The canonical SMILES for 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine is CCC1CCCCC1C(C)(N)C(C)CC.
What is the InChIKey of 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine?
The InChIKey is HPOYEGLJPFPTBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-5-11(3)14(4,15)13-10-8-7-9-12(13)6-2/h11-13H,5-10,15H2,1-4H3.
What are the key properties of 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine?
2-(2-ethylcyclohexyl)-3-methylpentan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylcyclohexyl)-3-methylpentan-2-amine is sourced from PubChem (CID 63861635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).