(Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine

C8H16N2 — CID 121327270

IUPAC(Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine
SMILESCC/C=C\CN/N=C\CC
InChIInChI=1S/C8H16N2/c1-3-5-6-8-10-9-7-4-2/h5-7,10H,3-4,8H2,1-2H3/b6-5-,9-7-
InChIKeyAXPGAUYDRQHHEU-LZWBOMALSA-N
MW140.23 g/mol
LogP1.94
Rot. Bonds5

About (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine

(Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine (PubChem CID 121327270) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine.

Molecular Properties

Compound Name(Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine
PubChem CID121327270
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine
SMILESCC/C=C\CN/N=C\CC
InChIInChI=1S/C8H16N2/c1-3-5-6-8-10-9-7-4-2/h5-7,10H,3-4,8H2,1-2H3/b6-5-,9-7-
InChIKeyAXPGAUYDRQHHEU-LZWBOMALSA-N
XLogP1.94
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine?
The IUPAC name of (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine (CID 121327270) is (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine.
What is the SMILES notation for (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine?
The canonical SMILES for (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine is CC/C=C\CN/N=C\CC.
What is the InChIKey of (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine?
The InChIKey is AXPGAUYDRQHHEU-LZWBOMALSA-N. The full InChI is InChI=1S/C8H16N2/c1-3-5-6-8-10-9-7-4-2/h5-7,10H,3-4,8H2,1-2H3/b6-5-,9-7-.
What are the key properties of (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine?
(Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(Z)-propylideneamino]pent-2-en-1-amine is sourced from PubChem (CID 121327270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).