N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide

C12H20N2O2 — CID 22507079

IUPACN,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide
SMILESCC1C=CC=CN1C(=O)N(C)OC(C)(C)C
InChIInChI=1S/C12H20N2O2/c1-10-8-6-7-9-14(10)11(15)13(5)16-12(2,3)4/h6-10H,1-5H3
InChIKeyYICOWKDUJUSULZ-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.54
Rot. Bonds1

About N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide

N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide (PubChem CID 22507079) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide
PubChem CID22507079
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide
SMILESCC1C=CC=CN1C(=O)N(C)OC(C)(C)C
InChIInChI=1S/C12H20N2O2/c1-10-8-6-7-9-14(10)11(15)13(5)16-12(2,3)4/h6-10H,1-5H3
InChIKeyYICOWKDUJUSULZ-UHFFFAOYSA-N
XLogP2.54
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide?
The IUPAC name of N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide (CID 22507079) is N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide.
What is the SMILES notation for N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide?
The canonical SMILES for N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide is CC1C=CC=CN1C(=O)N(C)OC(C)(C)C.
What is the InChIKey of N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide?
The InChIKey is YICOWKDUJUSULZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-10-8-6-7-9-14(10)11(15)13(5)16-12(2,3)4/h6-10H,1-5H3.
What are the key properties of N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide?
N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide has a molecular weight of 224.30 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[(2-methylpropan-2-yl)oxy]-2H-pyridine-1-carboxamide is sourced from PubChem (CID 22507079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).