N-ethyl-N,3-dimethylpent-3-en-1-amine

C9H19N — CID 141102807

IUPACN-ethyl-N,3-dimethylpent-3-en-1-amine
SMILESCC=C(C)CCN(C)CC
InChIInChI=1S/C9H19N/c1-5-9(3)7-8-10(4)6-2/h5H,6-8H2,1-4H3
InChIKeyBAXVLHZUXSMFIE-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.29
Rot. Bonds4

About N-ethyl-N,3-dimethylpent-3-en-1-amine

N-ethyl-N,3-dimethylpent-3-en-1-amine (PubChem CID 141102807) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-ethyl-N,3-dimethylpent-3-en-1-amine.

Molecular Properties

Compound NameN-ethyl-N,3-dimethylpent-3-en-1-amine
PubChem CID141102807
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-ethyl-N,3-dimethylpent-3-en-1-amine
SMILESCC=C(C)CCN(C)CC
InChIInChI=1S/C9H19N/c1-5-9(3)7-8-10(4)6-2/h5H,6-8H2,1-4H3
InChIKeyBAXVLHZUXSMFIE-UHFFFAOYSA-N
XLogP2.29
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 ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-ethyl-N,3-dimethylpent-3-en-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

2,6-Octadien-1-amine, N,N-diethyl-3,7-dimethyl-, (2E)-
CID 6390621
n,n-Diethyl-3.7-dimethyl-2.6-octadiene-1-amine
CID 324495
4-ethyl-1-methyl-3,6-dihydro-2H-pyridine
CID 21345321
1,5-Diethyl-1,2,3,6-tetrahydropyridine
CID 641110
Pyridine, 1,2,3,6-tetrahydro-1,4-dimethyl-
CID 11389372
4-Hexenylamine, N-ethyl-N,1,5-trimethyl-
CID 57940
N,N-Diethylazasqualene
CID 6439792
(Z)-N,N-Diethyl-3,7-dimethylocta-2,6-dien-1-amine
CID 6243343
Pyridine, 1,2,3,6-tetrahydro-1,5-dimethyl-
CID 12227310
Pyridine, 1,2,5,6-tetrahydro-1,2,4-trimethyl-
CID 23423765
N,N-dimethylamino-4-methyl-pentene-3
CID 12545385
1-(3,7-Dimethylocta-2,6-dienyl)pyrrolidine
CID 72951919

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,3-dimethylpent-3-en-1-amine?
The IUPAC name of N-ethyl-N,3-dimethylpent-3-en-1-amine (CID 141102807) is N-ethyl-N,3-dimethylpent-3-en-1-amine.
What is the SMILES notation for N-ethyl-N,3-dimethylpent-3-en-1-amine?
The canonical SMILES for N-ethyl-N,3-dimethylpent-3-en-1-amine is CC=C(C)CCN(C)CC.
What is the InChIKey of N-ethyl-N,3-dimethylpent-3-en-1-amine?
The InChIKey is BAXVLHZUXSMFIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-5-9(3)7-8-10(4)6-2/h5H,6-8H2,1-4H3.
What are the key properties of N-ethyl-N,3-dimethylpent-3-en-1-amine?
N-ethyl-N,3-dimethylpent-3-en-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,3-dimethylpent-3-en-1-amine is sourced from PubChem (CID 141102807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).