(Z)-3-pentan-2-yliminoprop-1-en-1-amine

C8H16N2 — CID 146659680

IUPAC(Z)-3-pentan-2-yliminoprop-1-en-1-amine
SMILESCCCC(C)/N=C/C=C\N
InChIInChI=1S/C8H16N2/c1-3-5-8(2)10-7-4-6-9/h4,6-8H,3,5,9H2,1-2H3/b6-4-,10-7+
InChIKeyIHLNSGXKUUKASQ-BSAFSDHNSA-N
MW140.23 g/mol
LogP1.72
Rot. Bonds4

About (Z)-3-pentan-2-yliminoprop-1-en-1-amine

(Z)-3-pentan-2-yliminoprop-1-en-1-amine (PubChem CID 146659680) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (Z)-3-pentan-2-yliminoprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-pentan-2-yliminoprop-1-en-1-amine
PubChem CID146659680
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(Z)-3-pentan-2-yliminoprop-1-en-1-amine
SMILESCCCC(C)/N=C/C=C\N
InChIInChI=1S/C8H16N2/c1-3-5-8(2)10-7-4-6-9/h4,6-8H,3,5,9H2,1-2H3/b6-4-,10-7+
InChIKeyIHLNSGXKUUKASQ-BSAFSDHNSA-N
XLogP1.72
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z)-3-pentan-2-yliminoprop-1-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

(Z)-3-methyliminoprop-1-en-1-amine
CID 59122072
3-Methyliminoprop-1-en-1-amine
CID 72522918
(Z)-3-prop-1-en-2-yliminoprop-1-en-1-amine
CID 88236263
(Z)-2-(prop-2-enylideneamino)prop-1-en-1-amine
CID 88885354
N-[(Z)-2-(prop-2-enylideneamino)ethenyl]propan-2-amine
CID 88918621
(Z)-3-propyliminoprop-1-en-1-amine
CID 88976127
N-[(Z)-3-iminoprop-1-enyl]pentan-2-imine
CID 89698301
4-[(Z)-prop-1-enyl]iminopentan-2-amine
CID 90051371
N-(3-iminoprop-1-enyl)hexan-1-imine
CID 91416294
(Z)-3-propan-2-yliminoprop-1-en-1-amine
CID 118566534
(Z)-3-(4,4-dimethylhexan-3-ylimino)prop-1-en-1-amine
CID 126672149
(Z)-3-pentan-3-yliminoprop-1-en-1-amine
CID 126672150

Frequently Asked Questions

What is the IUPAC name of (Z)-3-pentan-2-yliminoprop-1-en-1-amine?
The IUPAC name of (Z)-3-pentan-2-yliminoprop-1-en-1-amine (CID 146659680) is (Z)-3-pentan-2-yliminoprop-1-en-1-amine.
What is the SMILES notation for (Z)-3-pentan-2-yliminoprop-1-en-1-amine?
The canonical SMILES for (Z)-3-pentan-2-yliminoprop-1-en-1-amine is CCCC(C)/N=C/C=C\N.
What is the InChIKey of (Z)-3-pentan-2-yliminoprop-1-en-1-amine?
The InChIKey is IHLNSGXKUUKASQ-BSAFSDHNSA-N. The full InChI is InChI=1S/C8H16N2/c1-3-5-8(2)10-7-4-6-9/h4,6-8H,3,5,9H2,1-2H3/b6-4-,10-7+.
What are the key properties of (Z)-3-pentan-2-yliminoprop-1-en-1-amine?
(Z)-3-pentan-2-yliminoprop-1-en-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-pentan-2-yliminoprop-1-en-1-amine is sourced from PubChem (CID 146659680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).