N-tert-butyl-1-pyridin-2-ylmethanimine

C10H14N2 — CID 11389570

IUPACN-tert-butyl-1-pyridin-2-ylmethanimine
SMILESCC(C)(C)/N=C/c1ccccn1
InChIInChI=1S/C10H14N2/c1-10(2,3)12-8-9-6-4-5-7-11-9/h4-8H,1-3H3/b12-8+
InChIKeyYWWYTOLUQKRDTE-XYOKQWHBSA-N
MW162.24 g/mol
LogP2.30
Rot. Bonds1

About N-tert-butyl-1-pyridin-2-ylmethanimine

N-tert-butyl-1-pyridin-2-ylmethanimine (PubChem CID 11389570) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-tert-butyl-1-pyridin-2-ylmethanimine.

Molecular Properties

Compound NameN-tert-butyl-1-pyridin-2-ylmethanimine
PubChem CID11389570
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-tert-butyl-1-pyridin-2-ylmethanimine
SMILESCC(C)(C)/N=C/c1ccccn1
InChIInChI=1S/C10H14N2/c1-10(2,3)12-8-9-6-4-5-7-11-9/h4-8H,1-3H3/b12-8+
InChIKeyYWWYTOLUQKRDTE-XYOKQWHBSA-N
XLogP2.30
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.30
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

Nicotine
CID 89594
Pyridine
CID 1049
Cetylpyridinium Chloride
CID 31239
4-Aminopyridine
CID 1727
Ethionamide
CID 2761171
3-Methylpyridine
CID 7970
3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
4-Methylpyridine
CID 7963
2,2'-Bipyridine
CID 1474
Pheniramine
CID 4761
Prothionamide
CID 666418
Pralidoxime Chloride
CID 135445761

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-pyridin-2-ylmethanimine?
The IUPAC name of N-tert-butyl-1-pyridin-2-ylmethanimine (CID 11389570) is N-tert-butyl-1-pyridin-2-ylmethanimine.
What is the SMILES notation for N-tert-butyl-1-pyridin-2-ylmethanimine?
The canonical SMILES for N-tert-butyl-1-pyridin-2-ylmethanimine is CC(C)(C)/N=C/c1ccccn1.
What is the InChIKey of N-tert-butyl-1-pyridin-2-ylmethanimine?
The InChIKey is YWWYTOLUQKRDTE-XYOKQWHBSA-N. The full InChI is InChI=1S/C10H14N2/c1-10(2,3)12-8-9-6-4-5-7-11-9/h4-8H,1-3H3/b12-8+.
What are the key properties of N-tert-butyl-1-pyridin-2-ylmethanimine?
N-tert-butyl-1-pyridin-2-ylmethanimine has a molecular weight of 162.24 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-pyridin-2-ylmethanimine is sourced from PubChem (CID 11389570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).