(Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine

C8H9N3 — CID 143257869

IUPAC(Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine
SMILES[H]/N=C/C(=C\N)c1ccncc1
InChIInChI=1S/C8H9N3/c9-5-8(6-10)7-1-3-11-4-2-7/h1-6,9H,10H2/b8-6+,9-5+
InChIKeyPSCDWZYTQIPTGB-RFSWUZDDSA-N
MW147.18 g/mol
LogP1.03
Rot. Bonds2

About (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine

(Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine (PubChem CID 143257869) has the molecular formula C8H9N3 and a molecular weight of 147.18 g/mol. Its IUPAC name is (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine
PubChem CID143257869
Molecular FormulaC8H9N3
Molecular Weight147.18 g/mol
Exact Mass147.08
IUPAC Name(Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine
SMILES[H]/N=C/C(=C\N)c1ccncc1
InChIInChI=1S/C8H9N3/c9-5-8(6-10)7-1-3-11-4-2-7/h1-6,9H,10H2/b8-6+,9-5+
InChIKeyPSCDWZYTQIPTGB-RFSWUZDDSA-N
XLogP1.03
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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)-3-imino-2-pyridin-4-ylprop-1-en-1-amine?
The IUPAC name of (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine (CID 143257869) is (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine.
What is the SMILES notation for (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine?
The canonical SMILES for (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine is [H]/N=C/C(=C\N)c1ccncc1.
What is the InChIKey of (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine?
The InChIKey is PSCDWZYTQIPTGB-RFSWUZDDSA-N. The full InChI is InChI=1S/C8H9N3/c9-5-8(6-10)7-1-3-11-4-2-7/h1-6,9H,10H2/b8-6+,9-5+.
What are the key properties of (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine?
(Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine has a molecular weight of 147.18 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-imino-2-pyridin-4-ylprop-1-en-1-amine is sourced from PubChem (CID 143257869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).