(6-prop-1-en-2-yl-3-pyridinyl)methanimine

C9H10N2 — CID 130359150

IUPAC(6-prop-1-en-2-yl-3-pyridinyl)methanimine
SMILES[H]/N=C/c1ccc(C(=C)C)nc1
InChIInChI=1S/C9H10N2/c1-7(2)9-4-3-8(5-10)6-11-9/h3-6,10H,1H2,2H3/b10-5+
InChIKeyALPDMPKOGPUQKS-BJMVGYQFSA-N
MW146.19 g/mol
LogP2.11
Rot. Bonds2

About (6-prop-1-en-2-yl-3-pyridinyl)methanimine

(6-prop-1-en-2-yl-3-pyridinyl)methanimine (PubChem CID 130359150) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is (6-prop-1-en-2-yl-3-pyridinyl)methanimine.

Molecular Properties

Compound Name(6-prop-1-en-2-yl-3-pyridinyl)methanimine
PubChem CID130359150
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name(6-prop-1-en-2-yl-3-pyridinyl)methanimine
SMILES[H]/N=C/c1ccc(C(=C)C)nc1
InChIInChI=1S/C9H10N2/c1-7(2)9-4-3-8(5-10)6-11-9/h3-6,10H,1H2,2H3/b10-5+
InChIKeyALPDMPKOGPUQKS-BJMVGYQFSA-N
XLogP2.11
TPSA36.74 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.11
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 (6-prop-1-en-2-yl-3-pyridinyl)methanimine?
The IUPAC name of (6-prop-1-en-2-yl-3-pyridinyl)methanimine (CID 130359150) is (6-prop-1-en-2-yl-3-pyridinyl)methanimine.
What is the SMILES notation for (6-prop-1-en-2-yl-3-pyridinyl)methanimine?
The canonical SMILES for (6-prop-1-en-2-yl-3-pyridinyl)methanimine is [H]/N=C/c1ccc(C(=C)C)nc1.
What is the InChIKey of (6-prop-1-en-2-yl-3-pyridinyl)methanimine?
The InChIKey is ALPDMPKOGPUQKS-BJMVGYQFSA-N. The full InChI is InChI=1S/C9H10N2/c1-7(2)9-4-3-8(5-10)6-11-9/h3-6,10H,1H2,2H3/b10-5+.
What are the key properties of (6-prop-1-en-2-yl-3-pyridinyl)methanimine?
(6-prop-1-en-2-yl-3-pyridinyl)methanimine has a molecular weight of 146.19 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-prop-1-en-2-yl-3-pyridinyl)methanimine is sourced from PubChem (CID 130359150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).