(Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine

C11H20N2 — CID 134444549

IUPAC(Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine
SMILESC=CN/C(CC)=C(\N=C\C)C(C)C
InChIInChI=1S/C11H20N2/c1-6-10(12-7-2)11(9(4)5)13-8-3/h7-9,12H,2,6H2,1,3-5H3/b11-10-,13-8+
InChIKeyGVACDSVJEXSOHA-ANOMLPRKSA-N
MW180.29 g/mol
LogP3.09
Rot. Bonds5

About (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine

(Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine (PubChem CID 134444549) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine.

Molecular Properties

Compound Name(Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine
PubChem CID134444549
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name(Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine
SMILESC=CN/C(CC)=C(\N=C\C)C(C)C
InChIInChI=1S/C11H20N2/c1-6-10(12-7-2)11(9(4)5)13-8-3/h7-9,12H,2,6H2,1,3-5H3/b11-10-,13-8+
InChIKeyGVACDSVJEXSOHA-ANOMLPRKSA-N
XLogP3.09
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 53.09
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)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine?
The IUPAC name of (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine (CID 134444549) is (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine.
What is the SMILES notation for (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine?
The canonical SMILES for (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine is C=CN/C(CC)=C(\N=C\C)C(C)C.
What is the InChIKey of (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine?
The InChIKey is GVACDSVJEXSOHA-ANOMLPRKSA-N. The full InChI is InChI=1S/C11H20N2/c1-6-10(12-7-2)11(9(4)5)13-8-3/h7-9,12H,2,6H2,1,3-5H3/b11-10-,13-8+.
What are the key properties of (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine?
(Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine has a molecular weight of 180.29 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethenyl-4-(ethylideneamino)-5-methylhex-3-en-3-amine is sourced from PubChem (CID 134444549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).