(2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine

C18H35N — CID 89289069

IUPAC(2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine
SMILESCCCC(C)C/C=C\C(=C(/C)NC)C(C)(C)CCC
InChIInChI=1S/C18H35N/c1-8-11-15(3)12-10-13-17(16(4)19-7)18(5,6)14-9-2/h10,13,15,19H,8-9,11-12,14H2,1-7H3/b13-10-,17-16-
InChIKeyQMVTXBOLJXWDLD-GULLIVQYSA-N
MW265.48 g/mol
LogP5.69
Rot. Bonds9

About (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine

(2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine (PubChem CID 89289069) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine.

Molecular Properties

Compound Name(2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine
PubChem CID89289069
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC Name(2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine
SMILESCCCC(C)C/C=C\C(=C(/C)NC)C(C)(C)CCC
InChIInChI=1S/C18H35N/c1-8-11-15(3)12-10-13-17(16(4)19-7)18(5,6)14-9-2/h10,13,15,19H,8-9,11-12,14H2,1-7H3/b13-10-,17-16-
InChIKeyQMVTXBOLJXWDLD-GULLIVQYSA-N
XLogP5.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine?
The IUPAC name of (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine (CID 89289069) is (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine.
What is the SMILES notation for (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine?
The canonical SMILES for (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine is CCCC(C)C/C=C\C(=C(/C)NC)C(C)(C)CCC.
What is the InChIKey of (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine?
The InChIKey is QMVTXBOLJXWDLD-GULLIVQYSA-N. The full InChI is InChI=1S/C18H35N/c1-8-11-15(3)12-10-13-17(16(4)19-7)18(5,6)14-9-2/h10,13,15,19H,8-9,11-12,14H2,1-7H3/b13-10-,17-16-.
What are the key properties of (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine?
(2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine has a molecular weight of 265.48 g/mol, XLogP of 5.69, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-N,7-dimethyl-3-(2-methylpentan-2-yl)deca-2,4-dien-2-amine is sourced from PubChem (CID 89289069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).