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

C9H15N — CID 143910764

IUPAC(3Z,5Z)-2-methylideneocta-3,5-dien-1-amine
SMILESC=C(/C=C\C=C/CC)CN
InChIInChI=1S/C9H15N/c1-3-4-5-6-7-9(2)8-10/h4-7H,2-3,8,10H2,1H3/b5-4-,7-6-
InChIKeyKMXFXCJWCDZCQC-RZSVFLSASA-N
MW137.23 g/mol
LogP2.02
Rot. Bonds4

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

(3Z,5Z)-2-methylideneocta-3,5-dien-1-amine (PubChem CID 143910764) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine.

Molecular Properties

Compound Name(3Z,5Z)-2-methylideneocta-3,5-dien-1-amine
PubChem CID143910764
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name(3Z,5Z)-2-methylideneocta-3,5-dien-1-amine
SMILESC=C(/C=C\C=C/CC)CN
InChIInChI=1S/C9H15N/c1-3-4-5-6-7-9(2)8-10/h4-7H,2-3,8,10H2,1H3/b5-4-,7-6-
InChIKeyKMXFXCJWCDZCQC-RZSVFLSASA-N
XLogP2.02
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.02
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

(1Z,3Z,7Z,9Z)-N-methyl-5-methylidenedodeca-1,3,7,9-tetraen-1-amine
CID 145212515
(5E)-octa-3,5-diene
CID 173104147
(3Z,5E)-octa-3,5-dien-2-one
CID 6428552
(3Z,5E)-6-methyl-2-methylideneocta-3,5,7-trien-1-amine
CID 143819016
ethane;(3Z,5Z)-octa-3,5-diene
CID 142104932
ethane;(3Z)-hexa-1,3-dien-2-amine;propane
CID 144512893
(3Z,5Z)-N-methyl-N-[(3Z)-penta-1,3-dien-2-yl]octa-1,3,5-trien-2-amine
CID 155240504
(3E,5E,9Z)-dodeca-1,3,5,9-tetraen-2-ol
CID 89135352
ethyl hepta-2,4-dienoate
CID 54483010
(3E,5E)-octa-3,5-dien-1-amine
CID 55254846
(3Z,5Z)-7-aminohepta-1,3,5-triene-2-thiol
CID 89418541
(3E,5E,9Z)-2-iodododeca-1,3,5,9-tetraene
CID 89135344

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine?
The IUPAC name of (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine (CID 143910764) is (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine.
What is the SMILES notation for (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine?
The canonical SMILES for (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine is C=C(/C=C\C=C/CC)CN.
What is the InChIKey of (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine?
The InChIKey is KMXFXCJWCDZCQC-RZSVFLSASA-N. The full InChI is InChI=1S/C9H15N/c1-3-4-5-6-7-9(2)8-10/h4-7H,2-3,8,10H2,1H3/b5-4-,7-6-.
What are the key properties of (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine?
(3Z,5Z)-2-methylideneocta-3,5-dien-1-amine has a molecular weight of 137.23 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-2-methylideneocta-3,5-dien-1-amine is sourced from PubChem (CID 143910764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).