(2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine

C10H17N — CID 166922206

IUPAC(2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine
SMILESC/C=C\C(\C=C/CC)=C(/C)N
InChIInChI=1S/C10H17N/c1-4-6-8-10(7-5-2)9(3)11/h5-8H,4,11H2,1-3H3/b7-5-,8-6-,10-9-
InChIKeyQXQBOVBFOHBMJG-HDKJAUSJSA-N
MW151.25 g/mol
LogP2.76
Rot. Bonds3

About (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine

(2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine (PubChem CID 166922206) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine.

Molecular Properties

Compound Name(2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine
PubChem CID166922206
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine
SMILESC/C=C\C(\C=C/CC)=C(/C)N
InChIInChI=1S/C10H17N/c1-4-6-8-10(7-5-2)9(3)11/h5-8H,4,11H2,1-3H3/b7-5-,8-6-,10-9-
InChIKeyQXQBOVBFOHBMJG-HDKJAUSJSA-N
XLogP2.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-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 (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine?
The IUPAC name of (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine (CID 166922206) is (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine.
What is the SMILES notation for (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine?
The canonical SMILES for (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine is C/C=C\C(\C=C/CC)=C(/C)N.
What is the InChIKey of (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine?
The InChIKey is QXQBOVBFOHBMJG-HDKJAUSJSA-N. The full InChI is InChI=1S/C10H17N/c1-4-6-8-10(7-5-2)9(3)11/h5-8H,4,11H2,1-3H3/b7-5-,8-6-,10-9-.
What are the key properties of (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine?
(2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine has a molecular weight of 151.25 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-3-[(Z)-prop-1-enyl]hepta-2,4-dien-2-amine is sourced from PubChem (CID 166922206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).