(3E,5Z)-4-methylnona-1,3,5-trien-3-amine

C10H17N — CID 126687303

IUPAC(3E,5Z)-4-methylnona-1,3,5-trien-3-amine
SMILESC=C/C(N)=C(C)\C=C/CCC
InChIInChI=1S/C10H17N/c1-4-6-7-8-9(3)10(11)5-2/h5,7-8H,2,4,6,11H2,1,3H3/b8-7-,10-9+
InChIKeyRTTXHTWHHXMHCZ-UQGDGPGGSA-N
MW151.25 g/mol
LogP2.76
Rot. Bonds4

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

(3E,5Z)-4-methylnona-1,3,5-trien-3-amine (PubChem CID 126687303) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (3E,5Z)-4-methylnona-1,3,5-trien-3-amine.

Molecular Properties

Compound Name(3E,5Z)-4-methylnona-1,3,5-trien-3-amine
PubChem CID126687303
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(3E,5Z)-4-methylnona-1,3,5-trien-3-amine
SMILESC=C/C(N)=C(C)\C=C/CCC
InChIInChI=1S/C10H17N/c1-4-6-7-8-9(3)10(11)5-2/h5,7-8H,2,4,6,11H2,1,3H3/b8-7-,10-9+
InChIKeyRTTXHTWHHXMHCZ-UQGDGPGGSA-N
XLogP2.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
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 (3E,5Z)-4-methylnona-1,3,5-trien-3-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

(3E,5Z)-4-tert-butylnona-1,3,5-trien-3-amine
CID 129213211
(3E)-2-methylhepta-1,3-diene
CID 12928201
2-methylhepta-1,3-diene
CID 54310621
(3E,5Z)-3-methylocta-1,3,5-trien-4-amine
CID 88993026
hex-2-enamide;2-methylprop-2-enamide
CID 174909220
(E)-hex-2-enamide;hydrochloride
CID 141291310
(3E,5Z)-nona-3,5-dien-4-amine
CID 146251565
(3Z,5Z)-3-methylnona-1,3,5-triene
CID 144680511
3-methylnona-1,3,5-triene
CID 154088357
[(2E,4E)-2,3-dimethylocta-2,4-dienyl] propanoate
CID 101282982
N,N-dimethylpent-1-en-1-amine;prop-2-enamide
CID 175286985
acetic acid;(3Z)-2-methylhepta-1,3-diene;propane
CID 145349004

Frequently Asked Questions

What is the IUPAC name of (3E,5Z)-4-methylnona-1,3,5-trien-3-amine?
The IUPAC name of (3E,5Z)-4-methylnona-1,3,5-trien-3-amine (CID 126687303) is (3E,5Z)-4-methylnona-1,3,5-trien-3-amine.
What is the SMILES notation for (3E,5Z)-4-methylnona-1,3,5-trien-3-amine?
The canonical SMILES for (3E,5Z)-4-methylnona-1,3,5-trien-3-amine is C=C/C(N)=C(C)\C=C/CCC.
What is the InChIKey of (3E,5Z)-4-methylnona-1,3,5-trien-3-amine?
The InChIKey is RTTXHTWHHXMHCZ-UQGDGPGGSA-N. The full InChI is InChI=1S/C10H17N/c1-4-6-7-8-9(3)10(11)5-2/h5,7-8H,2,4,6,11H2,1,3H3/b8-7-,10-9+.
What are the key properties of (3E,5Z)-4-methylnona-1,3,5-trien-3-amine?
(3E,5Z)-4-methylnona-1,3,5-trien-3-amine has a molecular weight of 151.25 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,5Z)-4-methylnona-1,3,5-trien-3-amine is sourced from PubChem (CID 126687303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).