(E)-N,N-diethylpent-2-en-3-amine

C9H19N — CID 12664029

IUPAC(E)-N,N-diethylpent-2-en-3-amine
SMILESC/C=C(\CC)N(CC)CC
InChIInChI=1S/C9H19N/c1-5-9(6-2)10(7-3)8-4/h5H,6-8H2,1-4H3/b9-5+
InChIKeyJMATXPKPIDLDOJ-WEVVVXLNSA-N
MW141.26 g/mol
LogP2.64
Rot. Bonds4

About (E)-N,N-diethylpent-2-en-3-amine

(E)-N,N-diethylpent-2-en-3-amine (PubChem CID 12664029) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is (E)-N,N-diethylpent-2-en-3-amine.

Molecular Properties

Compound Name(E)-N,N-diethylpent-2-en-3-amine
PubChem CID12664029
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name(E)-N,N-diethylpent-2-en-3-amine
SMILESC/C=C(\CC)N(CC)CC
InChIInChI=1S/C9H19N/c1-5-9(6-2)10(7-3)8-4/h5H,6-8H2,1-4H3/b9-5+
InChIKeyJMATXPKPIDLDOJ-WEVVVXLNSA-N
XLogP2.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (E)-N,N-diethylpent-2-en-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-N,N-diethylpent-2-en-3-amine?
The IUPAC name of (E)-N,N-diethylpent-2-en-3-amine (CID 12664029) is (E)-N,N-diethylpent-2-en-3-amine.
What is the SMILES notation for (E)-N,N-diethylpent-2-en-3-amine?
The canonical SMILES for (E)-N,N-diethylpent-2-en-3-amine is C/C=C(\CC)N(CC)CC.
What is the InChIKey of (E)-N,N-diethylpent-2-en-3-amine?
The InChIKey is JMATXPKPIDLDOJ-WEVVVXLNSA-N. The full InChI is InChI=1S/C9H19N/c1-5-9(6-2)10(7-3)8-4/h5H,6-8H2,1-4H3/b9-5+.
What are the key properties of (E)-N,N-diethylpent-2-en-3-amine?
(E)-N,N-diethylpent-2-en-3-amine has a molecular weight of 141.26 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-diethylpent-2-en-3-amine is sourced from PubChem (CID 12664029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).