N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine

C10H14N2O — CID 141131461

IUPACN-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine
SMILESCC(C)(C)ON=Cc1ccccn1
InChIInChI=1S/C10H14N2O/c1-10(2,3)13-12-8-9-6-4-5-7-11-9/h4-8H,1-3H3
InChIKeyNTCWDFWSFOZCSJ-UHFFFAOYSA-N
MW178.24 g/mol
LogP2.23
Rot. Bonds2

About N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine

N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine (PubChem CID 141131461) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine.

Molecular Properties

Compound NameN-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine
PubChem CID141131461
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC NameN-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine
SMILESCC(C)(C)ON=Cc1ccccn1
InChIInChI=1S/C10H14N2O/c1-10(2,3)13-12-8-9-6-4-5-7-11-9/h4-8H,1-3H3
InChIKeyNTCWDFWSFOZCSJ-UHFFFAOYSA-N
XLogP2.23
TPSA34.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-tert-butyl-1-pyridin-2-ylmethanimine
CID 11389570
N-phenoxy-1-pyridin-2-ylmethanimine
CID 54492053
2-(2-pyridin-2-ylethenyl)pyridine
CID 161029843
[(Z)-pyridin-2-ylmethylideneamino] carbamate
CID 5381364
N-propyl-1-pyridin-2-ylmethanimine
CID 11205848
(2-methylpropan-2-yl)oxy-(pyridin-2-ylmethylidene)phosphane
CID 169097195
2-methyl-1-(pyridin-2-ylmethylideneamino)propane-2-thiol
CID 71362573
tetrakis(benzene-1,2-diol);bis(2-[(E)-2-pyridin-2-ylethenyl]pyridine)
CID 139185658
methanamine;2-[(Z)-prop-1-enyl]pyridine
CID 143751771
2-N-[(E)-pyridin-2-ylmethylideneamino]-3-N-[(Z)-[(3Z)-3-[(Z)-[(3E)-3-[(E)-pyridin-2-ylmethylidenehydrazinylidene]butan-2-ylidene]hydrazinylidene]butan-2-ylidene]amino]butane-2,3-diimine
CID 11979937
2-[(Z)-pent-1-enyl]pyridine
CID 45079869
8-[cyclohexyl(methyl)amino]-5-methyl-6-oxo-1,5-naphthyridine-2,7-dicarbonitrile;(E)-N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine
CID 168962638

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine?
The IUPAC name of N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine (CID 141131461) is N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine.
What is the SMILES notation for N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine?
The canonical SMILES for N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine is CC(C)(C)ON=Cc1ccccn1.
What is the InChIKey of N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine?
The InChIKey is NTCWDFWSFOZCSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-10(2,3)13-12-8-9-6-4-5-7-11-9/h4-8H,1-3H3.
What are the key properties of N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine?
N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine has a molecular weight of 178.24 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine is sourced from PubChem (CID 141131461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).