(Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine

C13H24N2 — CID 130290774

IUPAC(Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine
SMILESC/C=C\C(=N\C(=C/N)C(C)(C)C)C(C)C
InChIInChI=1S/C13H24N2/c1-7-8-11(10(2)3)15-12(9-14)13(4,5)6/h7-10H,14H2,1-6H3/b8-7-,12-9-,15-11-
InChIKeySWEACAZIRXDRGR-ADKHKFFASA-N
MW208.35 g/mol
LogP3.51
Rot. Bonds3

About (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine

(Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine (PubChem CID 130290774) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine
PubChem CID130290774
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name(Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine
SMILESC/C=C\C(=N\C(=C/N)C(C)(C)C)C(C)C
InChIInChI=1S/C13H24N2/c1-7-8-11(10(2)3)15-12(9-14)13(4,5)6/h7-10H,14H2,1-6H3/b8-7-,12-9-,15-11-
InChIKeySWEACAZIRXDRGR-ADKHKFFASA-N
XLogP3.51
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine?
The IUPAC name of (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine (CID 130290774) is (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine.
What is the SMILES notation for (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine?
The canonical SMILES for (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine is C/C=C\C(=N\C(=C/N)C(C)(C)C)C(C)C.
What is the InChIKey of (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine?
The InChIKey is SWEACAZIRXDRGR-ADKHKFFASA-N. The full InChI is InChI=1S/C13H24N2/c1-7-8-11(10(2)3)15-12(9-14)13(4,5)6/h7-10H,14H2,1-6H3/b8-7-,12-9-,15-11-.
What are the key properties of (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine?
(Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine has a molecular weight of 208.35 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3,3-dimethyl-2-[[(Z)-2-methylhex-4-en-3-ylidene]amino]but-1-en-1-amine is sourced from PubChem (CID 130290774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).