4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine

C9H10N2 — CID 144881546

IUPAC4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine
SMILESC=C1C=CN=C/C1=N\C=C/C
InChIInChI=1S/C9H10N2/c1-3-5-11-9-7-10-6-4-8(9)2/h3-7H,2H2,1H3/b5-3-,11-9+
InChIKeyOQNVAGGOYNRMSJ-JZGMVQQJSA-N
MW146.19 g/mol
LogP2.12
Rot. Bonds1

About 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine

4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine (PubChem CID 144881546) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine.

Molecular Properties

Compound Name4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine
PubChem CID144881546
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine
SMILESC=C1C=CN=C/C1=N\C=C/C
InChIInChI=1S/C9H10N2/c1-3-5-11-9-7-10-6-4-8(9)2/h3-7H,2H2,1H3/b5-3-,11-9+
InChIKeyOQNVAGGOYNRMSJ-JZGMVQQJSA-N
XLogP2.12
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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N-methyl-3H-pyridin-4-imine
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N-propyl-3H-pyridin-4-imine
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3,8-Diazabicyclo[4.2.0]octa-1,3,5,7-tetraene
CID 56972315
propane;2H-pyrido[3,4-d]pyrimidin-2-ide;yttrium
CID 58547126
propane;2H-pyrido[4,3-d]pyrimidin-2-ide;yttrium
CID 58547370
7H-pyrrolo[3,2-c]pyridine
CID 67216888
N-methyl-4H-pyridin-3-imine
CID 67496115
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CID 68179744

Frequently Asked Questions

What is the IUPAC name of 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine?
The IUPAC name of 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine (CID 144881546) is 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine.
What is the SMILES notation for 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine?
The canonical SMILES for 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine is C=C1C=CN=C/C1=N\C=C/C.
What is the InChIKey of 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine?
The InChIKey is OQNVAGGOYNRMSJ-JZGMVQQJSA-N. The full InChI is InChI=1S/C9H10N2/c1-3-5-11-9-7-10-6-4-8(9)2/h3-7H,2H2,1H3/b5-3-,11-9+.
What are the key properties of 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine?
4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine has a molecular weight of 146.19 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylidene-N-[(Z)-prop-1-enyl]pyridin-3-imine is sourced from PubChem (CID 144881546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).