1-cyclopropyl-N-pyridin-3-ylmethanimine

C9H10N2 — CID 67423890

IUPAC1-cyclopropyl-N-pyridin-3-ylmethanimine
SMILESC(=N/c1cccnc1)\C1CC1
InChIInChI=1S/C9H10N2/c1-2-9(7-10-5-1)11-6-8-3-4-8/h1-2,5-8H,3-4H2/b11-6+
InChIKeyNEPTZDCSJVUYBA-IZZDOVSWSA-N
MW146.19 g/mol
LogP2.19
Rot. Bonds2

About 1-cyclopropyl-N-pyridin-3-ylmethanimine

1-cyclopropyl-N-pyridin-3-ylmethanimine (PubChem CID 67423890) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 1-cyclopropyl-N-pyridin-3-ylmethanimine.

Molecular Properties

Compound Name1-cyclopropyl-N-pyridin-3-ylmethanimine
PubChem CID67423890
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name1-cyclopropyl-N-pyridin-3-ylmethanimine
SMILESC(=N/c1cccnc1)\C1CC1
InChIInChI=1S/C9H10N2/c1-2-9(7-10-5-1)11-6-8-3-4-8/h1-2,5-8H,3-4H2/b11-6+
InChIKeyNEPTZDCSJVUYBA-IZZDOVSWSA-N
XLogP2.19
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.19
H-Bond Donors ≤ 50
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 1-cyclopropyl-N-pyridin-3-ylmethanimine?
The IUPAC name of 1-cyclopropyl-N-pyridin-3-ylmethanimine (CID 67423890) is 1-cyclopropyl-N-pyridin-3-ylmethanimine.
What is the SMILES notation for 1-cyclopropyl-N-pyridin-3-ylmethanimine?
The canonical SMILES for 1-cyclopropyl-N-pyridin-3-ylmethanimine is C(=N/c1cccnc1)\C1CC1.
What is the InChIKey of 1-cyclopropyl-N-pyridin-3-ylmethanimine?
The InChIKey is NEPTZDCSJVUYBA-IZZDOVSWSA-N. The full InChI is InChI=1S/C9H10N2/c1-2-9(7-10-5-1)11-6-8-3-4-8/h1-2,5-8H,3-4H2/b11-6+.
What are the key properties of 1-cyclopropyl-N-pyridin-3-ylmethanimine?
1-cyclopropyl-N-pyridin-3-ylmethanimine has a molecular weight of 146.19 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-pyridin-3-ylmethanimine is sourced from PubChem (CID 67423890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).