N-propyl-1-pyridin-2-ylmethanimine

C9H12N2 — CID 11205848

IUPACN-propyl-1-pyridin-2-ylmethanimine
SMILESCCC/N=C/c1ccccn1
InChIInChI=1S/C9H12N2/c1-2-6-10-8-9-5-3-4-7-11-9/h3-5,7-8H,2,6H2,1H3/b10-8+
InChIKeyCWKYKJQWSSZVDF-CSKARUKUSA-N
MW148.21 g/mol
LogP1.91
Rot. Bonds3

About N-propyl-1-pyridin-2-ylmethanimine

N-propyl-1-pyridin-2-ylmethanimine (PubChem CID 11205848) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is N-propyl-1-pyridin-2-ylmethanimine.

Molecular Properties

Compound NameN-propyl-1-pyridin-2-ylmethanimine
PubChem CID11205848
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC NameN-propyl-1-pyridin-2-ylmethanimine
SMILESCCC/N=C/c1ccccn1
InChIInChI=1S/C9H12N2/c1-2-6-10-8-9-5-3-4-7-11-9/h3-5,7-8H,2,6H2,1H3/b10-8+
InChIKeyCWKYKJQWSSZVDF-CSKARUKUSA-N
XLogP1.91
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.91
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

N-methyl-2-(pyridin-2-ylmethylideneamino)ethanamine
CID 101461429
dichloropalladium;N-dodecyl-1-pyridin-2-ylmethanimine
CID 11190208
(1Z,5Z)-cycloocta-1,5-diene;N-ethyl-1-pyridin-2-ylmethanimine;rhodium;chloride
CID 6442081
N-(2-phenylethyl)-1-pyridin-2-ylmethanimine
CID 15790389
2-[2-(pyridin-2-ylmethylideneamino)ethyliminomethyl]phenol
CID 136763146
2-methyl-1-(pyridin-2-ylmethylideneamino)propane-2-thiol
CID 71362573
1-(6-pyridin-2-yl-2-pyridinyl)-N-[2-[(6-pyridin-2-yl-2-pyridinyl)methylideneamino]ethyl]methanimine
CID 102521217
zinc;N,N-dimethyl-2-(pyridin-2-ylmethylideneamino)ethanamine;diisothiocyanate
CID 139068771
N',N'-bis[2-(pyridin-2-ylmethylideneamino)ethyl]ethane-1,2-diamine
CID 135011278
1,1'-biphenyl;carbanide;cobalt;N-(2-phosphanylethyl)-1-pyridin-2-ylmethanimine
CID 158437244
cadmium(2+);2-(pyridin-2-ylmethylideneamino)-N,N-bis[2-(pyridin-2-ylmethylideneamino)ethyl]ethanamine;diperchlorate
CID 139071417
N-(pyridin-2-ylmethyl)-2-(pyridin-2-ylmethylideneamino)-N-[2-(pyridin-2-ylmethylideneamino)ethyl]ethanamine
CID 102034985

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-pyridin-2-ylmethanimine?
The IUPAC name of N-propyl-1-pyridin-2-ylmethanimine (CID 11205848) is N-propyl-1-pyridin-2-ylmethanimine.
What is the SMILES notation for N-propyl-1-pyridin-2-ylmethanimine?
The canonical SMILES for N-propyl-1-pyridin-2-ylmethanimine is CCC/N=C/c1ccccn1.
What is the InChIKey of N-propyl-1-pyridin-2-ylmethanimine?
The InChIKey is CWKYKJQWSSZVDF-CSKARUKUSA-N. The full InChI is InChI=1S/C9H12N2/c1-2-6-10-8-9-5-3-4-7-11-9/h3-5,7-8H,2,6H2,1H3/b10-8+.
What are the key properties of N-propyl-1-pyridin-2-ylmethanimine?
N-propyl-1-pyridin-2-ylmethanimine has a molecular weight of 148.21 g/mol, XLogP of 1.91, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-pyridin-2-ylmethanimine is sourced from PubChem (CID 11205848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).