(Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine

C20H32N2 — CID 166826602

IUPAC(Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine
SMILESC=N/C=C(/C)NC/C(=C\C(=C)/C(=C/CC)CCCC)C1CC1
InChIInChI=1S/C20H32N2/c1-6-8-10-18(9-7-2)16(3)13-20(19-11-12-19)15-22-17(4)14-21-5/h9,13-14,19,22H,3,5-8,10-12,15H2,1-2,4H3/b17-14-,18-9+,20-13+
InChIKeyXGPYJBYAANVIBT-GOIOLPHRSA-N
MW300.49 g/mol
LogP5.56
Rot. Bonds11

About (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine

(Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine (PubChem CID 166826602) has the molecular formula C20H32N2 and a molecular weight of 300.49 g/mol. Its IUPAC name is (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine.

Molecular Properties

Compound Name(Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine
PubChem CID166826602
Molecular FormulaC20H32N2
Molecular Weight300.49 g/mol
Exact Mass300.26
IUPAC Name(Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine
SMILESC=N/C=C(/C)NC/C(=C\C(=C)/C(=C/CC)CCCC)C1CC1
InChIInChI=1S/C20H32N2/c1-6-8-10-18(9-7-2)16(3)13-20(19-11-12-19)15-22-17(4)14-21-5/h9,13-14,19,22H,3,5-8,10-12,15H2,1-2,4H3/b17-14-,18-9+,20-13+
InChIKeyXGPYJBYAANVIBT-GOIOLPHRSA-N
XLogP5.56
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.49
LogP ≤ 55.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-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 (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine?
The IUPAC name of (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine (CID 166826602) is (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine.
What is the SMILES notation for (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine?
The canonical SMILES for (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine is C=N/C=C(/C)NC/C(=C\C(=C)/C(=C/CC)CCCC)C1CC1.
What is the InChIKey of (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine?
The InChIKey is XGPYJBYAANVIBT-GOIOLPHRSA-N. The full InChI is InChI=1S/C20H32N2/c1-6-8-10-18(9-7-2)16(3)13-20(19-11-12-19)15-22-17(4)14-21-5/h9,13-14,19,22H,3,5-8,10-12,15H2,1-2,4H3/b17-14-,18-9+,20-13+.
What are the key properties of (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine?
(Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine has a molecular weight of 300.49 g/mol, XLogP of 5.56, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,5E)-2-cyclopropyl-4-methylidene-N-[(Z)-1-(methylideneamino)prop-1-en-2-yl]-5-propylidenenon-2-en-1-amine is sourced from PubChem (CID 166826602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).