(3Z,5Z)-2-methylhepta-3,5-dien-1-amine

C8H15N — CID 89062139

IUPAC(3Z,5Z)-2-methylhepta-3,5-dien-1-amine
SMILESC/C=C\C=C/C(C)CN
InChIInChI=1S/C8H15N/c1-3-4-5-6-8(2)7-9/h3-6,8H,7,9H2,1-2H3/b4-3-,6-5-
InChIKeyMVEFXVSMIDMEPV-OUPQRBNQSA-N
MW125.21 g/mol
LogP1.71
Rot. Bonds3

About (3Z,5Z)-2-methylhepta-3,5-dien-1-amine

(3Z,5Z)-2-methylhepta-3,5-dien-1-amine (PubChem CID 89062139) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is (3Z,5Z)-2-methylhepta-3,5-dien-1-amine.

Molecular Properties

Compound Name(3Z,5Z)-2-methylhepta-3,5-dien-1-amine
PubChem CID89062139
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name(3Z,5Z)-2-methylhepta-3,5-dien-1-amine
SMILESC/C=C\C=C/C(C)CN
InChIInChI=1S/C8H15N/c1-3-4-5-6-8(2)7-9/h3-6,8H,7,9H2,1-2H3/b4-3-,6-5-
InChIKeyMVEFXVSMIDMEPV-OUPQRBNQSA-N
XLogP1.71
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3Z,5Z)-hepta-3,5-dien-2-amine
CID 139386653
4-methylpent-2-ene-1,5-diamine
CID 154632735
(4Z,6Z)-3-ethylocta-4,6-dien-1-amine
CID 89156620
(2Z,4Z,6E,8S)-8-fluoronona-2,4,6-triene
CID 88997135
(4E)-hexa-2,4-diene
CID 22435466
(2Z,4E)-6-methoxyhepta-2,4-diene
CID 58952970
(3E,6E,8E)-5-methyldeca-1,3,6,8-tetraene
CID 132576789
(1Z,3Z)-5-methylhepta-1,3-dien-1-amine
CID 144815707
[(3E,5E)-hepta-3,5-dien-2-yl] acetate
CID 12755488
7-methylocta-2,4-diene
CID 519923
ethane;(2Z,4Z)-hexa-2,4-diene
CID 90738434
(5Z,7Z)-3-methylnona-1,5,7-triene
CID 142930221

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-2-methylhepta-3,5-dien-1-amine?
The IUPAC name of (3Z,5Z)-2-methylhepta-3,5-dien-1-amine (CID 89062139) is (3Z,5Z)-2-methylhepta-3,5-dien-1-amine.
What is the SMILES notation for (3Z,5Z)-2-methylhepta-3,5-dien-1-amine?
The canonical SMILES for (3Z,5Z)-2-methylhepta-3,5-dien-1-amine is C/C=C\C=C/C(C)CN.
What is the InChIKey of (3Z,5Z)-2-methylhepta-3,5-dien-1-amine?
The InChIKey is MVEFXVSMIDMEPV-OUPQRBNQSA-N. The full InChI is InChI=1S/C8H15N/c1-3-4-5-6-8(2)7-9/h3-6,8H,7,9H2,1-2H3/b4-3-,6-5-.
What are the key properties of (3Z,5Z)-2-methylhepta-3,5-dien-1-amine?
(3Z,5Z)-2-methylhepta-3,5-dien-1-amine has a molecular weight of 125.21 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-2-methylhepta-3,5-dien-1-amine is sourced from PubChem (CID 89062139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).