1-(pent-3-en-2-ylideneamino)ethanamine

C7H14N2 — CID 123330038

IUPAC1-(pent-3-en-2-ylideneamino)ethanamine
SMILESCC=CC(C)=NC(C)N
InChIInChI=1S/C7H14N2/c1-4-5-6(2)9-7(3)8/h4-5,7H,8H2,1-3H3
InChIKeyHYRSVCFBFVTFFI-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.33
Rot. Bonds2

About 1-(pent-3-en-2-ylideneamino)ethanamine

1-(pent-3-en-2-ylideneamino)ethanamine (PubChem CID 123330038) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 1-(pent-3-en-2-ylideneamino)ethanamine.

Molecular Properties

Compound Name1-(pent-3-en-2-ylideneamino)ethanamine
PubChem CID123330038
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name1-(pent-3-en-2-ylideneamino)ethanamine
SMILESCC=CC(C)=NC(C)N
InChIInChI=1S/C7H14N2/c1-4-5-6(2)9-7(3)8/h4-5,7H,8H2,1-3H3
InChIKeyHYRSVCFBFVTFFI-UHFFFAOYSA-N
XLogP1.33
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 1-(pent-3-en-2-ylideneamino)ethanamine 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

2,3-Dihydropyridin-2-amine
CID 18669108
(3-Fluoro-2,3-dihydropyridin-6-yl)methanamine
CID 91464248
(Z)-2-ethylimino-5-fluorohex-3-en-1-amine
CID 143075712
(E)-4-fluoro-1-(propan-2-ylideneamino)but-3-en-1-amine
CID 164152672
2-Methylpyrrol-2-amine
CID 57074855
2H-pyrrol-5-ylmethanamine
CID 67991228
4-N-methylcyclohexa-2,5-diene-1,4-diimine
CID 70148626
2,3-Dihydropyridin-6-ylmethanamine
CID 70426662
N-[(Z)-pent-3-en-2-ylidene]methanimidamide
CID 87693670
(Z)-4-ethenyliminopent-2-en-2-amine
CID 89224049
2,6-dimethyl-3H-pyridin-2-amine
CID 89339074
(Z)-5-N-methylhex-3-ene-2,5-diimine
CID 89591069

Frequently Asked Questions

What is the IUPAC name of 1-(pent-3-en-2-ylideneamino)ethanamine?
The IUPAC name of 1-(pent-3-en-2-ylideneamino)ethanamine (CID 123330038) is 1-(pent-3-en-2-ylideneamino)ethanamine.
What is the SMILES notation for 1-(pent-3-en-2-ylideneamino)ethanamine?
The canonical SMILES for 1-(pent-3-en-2-ylideneamino)ethanamine is CC=CC(C)=NC(C)N.
What is the InChIKey of 1-(pent-3-en-2-ylideneamino)ethanamine?
The InChIKey is HYRSVCFBFVTFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-4-5-6(2)9-7(3)8/h4-5,7H,8H2,1-3H3.
What are the key properties of 1-(pent-3-en-2-ylideneamino)ethanamine?
1-(pent-3-en-2-ylideneamino)ethanamine has a molecular weight of 126.20 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(pent-3-en-2-ylideneamino)ethanamine is sourced from PubChem (CID 123330038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).