(E)-N-(2-methylpropyl)hex-2-en-3-amine

C10H21N — CID 174271616

IUPAC(E)-N-(2-methylpropyl)hex-2-en-3-amine
SMILESC/C=C(\CCC)NCC(C)C
InChIInChI=1S/C10H21N/c1-5-7-10(6-2)11-8-9(3)4/h6,9,11H,5,7-8H2,1-4H3/b10-6+
InChIKeyKKLDDTZGGUFYNL-UXBLZVDNSA-N
MW155.28 g/mol
LogP2.94
Rot. Bonds5

About (E)-N-(2-methylpropyl)hex-2-en-3-amine

(E)-N-(2-methylpropyl)hex-2-en-3-amine (PubChem CID 174271616) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (E)-N-(2-methylpropyl)hex-2-en-3-amine.

Molecular Properties

Compound Name(E)-N-(2-methylpropyl)hex-2-en-3-amine
PubChem CID174271616
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(E)-N-(2-methylpropyl)hex-2-en-3-amine
SMILESC/C=C(\CCC)NCC(C)C
InChIInChI=1S/C10H21N/c1-5-7-10(6-2)11-8-9(3)4/h6,9,11H,5,7-8H2,1-4H3/b10-6+
InChIKeyKKLDDTZGGUFYNL-UXBLZVDNSA-N
XLogP2.94
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-N-(2-methylpropyl)hex-2-en-3-amine?
The IUPAC name of (E)-N-(2-methylpropyl)hex-2-en-3-amine (CID 174271616) is (E)-N-(2-methylpropyl)hex-2-en-3-amine.
What is the SMILES notation for (E)-N-(2-methylpropyl)hex-2-en-3-amine?
The canonical SMILES for (E)-N-(2-methylpropyl)hex-2-en-3-amine is C/C=C(\CCC)NCC(C)C.
What is the InChIKey of (E)-N-(2-methylpropyl)hex-2-en-3-amine?
The InChIKey is KKLDDTZGGUFYNL-UXBLZVDNSA-N. The full InChI is InChI=1S/C10H21N/c1-5-7-10(6-2)11-8-9(3)4/h6,9,11H,5,7-8H2,1-4H3/b10-6+.
What are the key properties of (E)-N-(2-methylpropyl)hex-2-en-3-amine?
(E)-N-(2-methylpropyl)hex-2-en-3-amine has a molecular weight of 155.28 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2-methylpropyl)hex-2-en-3-amine is sourced from PubChem (CID 174271616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).