(2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine

C13H19N — CID 167289416

IUPAC(2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine
SMILESC=C/C=C\C=C/C=C(C)/C(C)=C(/C)N
InChIInChI=1S/C13H19N/c1-5-6-7-8-9-10-11(2)12(3)13(4)14/h5-10H,1,14H2,2-4H3/b7-6-,9-8-,11-10+,13-12-
InChIKeyAKCHENRBXLSRJK-NXFHKJDVSA-N
MW189.30 g/mol
LogP3.48
Rot. Bonds4

About (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine

(2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine (PubChem CID 167289416) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine.

Molecular Properties

Compound Name(2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine
PubChem CID167289416
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name(2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine
SMILESC=C/C=C\C=C/C=C(C)/C(C)=C(/C)N
InChIInChI=1S/C13H19N/c1-5-6-7-8-9-10-11(2)12(3)13(4)14/h5-10H,1,14H2,2-4H3/b7-6-,9-8-,11-10+,13-12-
InChIKeyAKCHENRBXLSRJK-NXFHKJDVSA-N
XLogP3.48
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine with MolForge

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Related Compounds

6-bromohepta-1,3,5-triene
CID 123654102
carbamoyl (2E,4E)-2-methylhepta-2,4,6-trieneperoxoate
CID 142683582
(2E,4E)-hepta-2,4,6-trien-2-ol
CID 173388700
N-amino-N-methyl-N'-[(3E,5Z)-3-methylocta-1,3,5,7-tetraen-2-yl]methanimidamide
CID 143086572
(4E,6Z)-4-methylnona-1,4,6,8-tetraen-2-amine
CID 155465991
(3E,5E,7E,9E,11E,13E,15E)-octadeca-1,3,5,7,9,11,13,15,17-nonaene
CID 15379303
(2Z,4Z)-3,4,6-trimethylhepta-2,4,6-trien-2-amine
CID 126639396
(3Z,5Z)-3-methylocta-3,5,7-trien-1-amine
CID 89153979
6-methoxyhepta-1,3,5-triene
CID 90882924
(3E,5Z)-N,N-dimethylocta-1,3,5,7-tetraen-3-amine
CID 170211366
(3E,5Z)-3-ethenylocta-3,5,7-trien-2-one
CID 129142506
(3Z,5Z,7E)-6-methylnona-1,3,5,7-tetraene
CID 144512529

Frequently Asked Questions

What is the IUPAC name of (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine?
The IUPAC name of (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine (CID 167289416) is (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine.
What is the SMILES notation for (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine?
The canonical SMILES for (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine is C=C/C=C\C=C/C=C(C)/C(C)=C(/C)N.
What is the InChIKey of (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine?
The InChIKey is AKCHENRBXLSRJK-NXFHKJDVSA-N. The full InChI is InChI=1S/C13H19N/c1-5-6-7-8-9-10-11(2)12(3)13(4)14/h5-10H,1,14H2,2-4H3/b7-6-,9-8-,11-10+,13-12-.
What are the key properties of (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine?
(2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine has a molecular weight of 189.30 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4E,6Z,8Z)-3,4-dimethylundeca-2,4,6,8,10-pentaen-2-amine is sourced from PubChem (CID 167289416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).