4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine

C10H14N2 — CID 90392293

IUPAC4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine
SMILESC/C=C\C=C/C1=CC(N)NC=C1
InChIInChI=1S/C10H14N2/c1-2-3-4-5-9-6-7-12-10(11)8-9/h2-8,10,12H,11H2,1H3/b3-2-,5-4-
InChIKeyFGDRGMGAHCXTSN-LDIADDGTSA-N
MW162.24 g/mol
LogP1.45
Rot. Bonds2

About 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine

4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine (PubChem CID 90392293) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine.

Molecular Properties

Compound Name4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine
PubChem CID90392293
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine
SMILESC/C=C\C=C/C1=CC(N)NC=C1
InChIInChI=1S/C10H14N2/c1-2-3-4-5-9-6-7-12-10(11)8-9/h2-8,10,12H,11H2,1H3/b3-2-,5-4-
InChIKeyFGDRGMGAHCXTSN-LDIADDGTSA-N
XLogP1.45
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine?
The IUPAC name of 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine (CID 90392293) is 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine.
What is the SMILES notation for 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine?
The canonical SMILES for 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine is C/C=C\C=C/C1=CC(N)NC=C1.
What is the InChIKey of 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine?
The InChIKey is FGDRGMGAHCXTSN-LDIADDGTSA-N. The full InChI is InChI=1S/C10H14N2/c1-2-3-4-5-9-6-7-12-10(11)8-9/h2-8,10,12H,11H2,1H3/b3-2-,5-4-.
What are the key properties of 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine?
4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine has a molecular weight of 162.24 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1Z,3Z)-penta-1,3-dienyl]-1,2-dihydropyridin-2-amine is sourced from PubChem (CID 90392293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).