(Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine

C10H18N2 — CID 170078873

IUPAC(Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine
SMILESC=C/C(=N\C=C/NC)C(C)(C)C
InChIInChI=1S/C10H18N2/c1-6-9(10(2,3)4)12-8-7-11-5/h6-8,11H,1H2,2-5H3/b8-7-,12-9+
InChIKeyYNSZDQXUYBLHJY-HVTAIUIQSA-N
MW166.27 g/mol
LogP2.35
Rot. Bonds3

About (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine

(Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine (PubChem CID 170078873) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine.

Molecular Properties

Compound Name(Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine
PubChem CID170078873
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name(Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine
SMILESC=C/C(=N\C=C/NC)C(C)(C)C
InChIInChI=1S/C10H18N2/c1-6-9(10(2,3)4)12-8-7-11-5/h6-8,11H,1H2,2-5H3/b8-7-,12-9+
InChIKeyYNSZDQXUYBLHJY-HVTAIUIQSA-N
XLogP2.35
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.35
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)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine?
The IUPAC name of (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine (CID 170078873) is (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine.
What is the SMILES notation for (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine?
The canonical SMILES for (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine is C=C/C(=N\C=C/NC)C(C)(C)C.
What is the InChIKey of (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine?
The InChIKey is YNSZDQXUYBLHJY-HVTAIUIQSA-N. The full InChI is InChI=1S/C10H18N2/c1-6-9(10(2,3)4)12-8-7-11-5/h6-8,11H,1H2,2-5H3/b8-7-,12-9+.
What are the key properties of (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine?
(Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine has a molecular weight of 166.27 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(4,4-dimethylpent-1-en-3-ylideneamino)-N-methylethenamine is sourced from PubChem (CID 170078873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).