(3Z,5Z)-hepta-1,3,5-trien-4-amine

C7H11N — CID 171106725

IUPAC(3Z,5Z)-hepta-1,3,5-trien-4-amine
SMILESC=C/C=C(N)/C=C\C
InChIInChI=1S/C7H11N/c1-3-5-7(8)6-4-2/h3-6H,1,8H2,2H3/b6-4-,7-5-
InChIKeyLSIBRBYLLCRTBZ-PEPZGXQESA-N
MW109.17 g/mol
LogP1.59
Rot. Bonds2

About (3Z,5Z)-hepta-1,3,5-trien-4-amine

(3Z,5Z)-hepta-1,3,5-trien-4-amine (PubChem CID 171106725) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is (3Z,5Z)-hepta-1,3,5-trien-4-amine.

Molecular Properties

Compound Name(3Z,5Z)-hepta-1,3,5-trien-4-amine
PubChem CID171106725
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name(3Z,5Z)-hepta-1,3,5-trien-4-amine
SMILESC=C/C=C(N)/C=C\C
InChIInChI=1S/C7H11N/c1-3-5-7(8)6-4-2/h3-6H,1,8H2,2H3/b6-4-,7-5-
InChIKeyLSIBRBYLLCRTBZ-PEPZGXQESA-N
XLogP1.59
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (3Z,5Z)-hepta-1,3,5-trien-4-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

N,N-dimethylmethanamine;(3E,5Z)-hepta-1,3,5-trien-4-amine
CID 144734718
(2Z,4E,6E)-octa-2,4,6-trien-4-amine
CID 89113450
ethane;[(3E,5Z)-hepta-1,3,5-trien-4-yl]hydrazine
CID 142089617
(1E,3E,5Z)-4-aminohepta-1,3,5-trien-1-ol
CID 88558814
(3E,5Z)-8-methyl-7-methylidenenona-1,3,5-trien-4-amine
CID 144536498
(3E,5Z)-N-iodohepta-1,3,5-trien-4-amine
CID 144727165
N-[(3E,5Z)-hepta-1,3,5-trien-4-yl]thiohydroxylamine
CID 143724474
(3E,5E,7E)-4,5,6-trimethylnona-1,3,5,7-tetraene
CID 21336128
(3E,5Z,7Z)-6-methylnona-1,3,5,7-tetraen-3-amine
CID 143332399
propane;(5Z)-4-[(E)-prop-1-enyl]hepta-1,3,5-triene
CID 143651334
(2E)-1-phosphanylidenepenta-2,4-dien-2-amine
CID 135159127
(1Z,3Z)-2-methyl-3-[(Z)-prop-1-enyl]hexa-1,3,5-trien-1-amine
CID 88576528

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-hepta-1,3,5-trien-4-amine?
The IUPAC name of (3Z,5Z)-hepta-1,3,5-trien-4-amine (CID 171106725) is (3Z,5Z)-hepta-1,3,5-trien-4-amine.
What is the SMILES notation for (3Z,5Z)-hepta-1,3,5-trien-4-amine?
The canonical SMILES for (3Z,5Z)-hepta-1,3,5-trien-4-amine is C=C/C=C(N)/C=C\C.
What is the InChIKey of (3Z,5Z)-hepta-1,3,5-trien-4-amine?
The InChIKey is LSIBRBYLLCRTBZ-PEPZGXQESA-N. The full InChI is InChI=1S/C7H11N/c1-3-5-7(8)6-4-2/h3-6H,1,8H2,2H3/b6-4-,7-5-.
What are the key properties of (3Z,5Z)-hepta-1,3,5-trien-4-amine?
(3Z,5Z)-hepta-1,3,5-trien-4-amine has a molecular weight of 109.17 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-hepta-1,3,5-trien-4-amine is sourced from PubChem (CID 171106725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).