N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide

C10H14N2O2 — CID 110848373

IUPACN-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide
SMILESCC(C)CNC(=O)c1cc(=O)cc[nH]1
InChIInChI=1S/C10H14N2O2/c1-7(2)6-12-10(14)9-5-8(13)3-4-11-9/h3-5,7H,6H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyMGLQYVRFPVNUCJ-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.76
Rot. Bonds3

About N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide

N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide (PubChem CID 110848373) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide
PubChem CID110848373
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide
SMILESCC(C)CNC(=O)c1cc(=O)cc[nH]1
InChIInChI=1S/C10H14N2O2/c1-7(2)6-12-10(14)9-5-8(13)3-4-11-9/h3-5,7H,6H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyMGLQYVRFPVNUCJ-UHFFFAOYSA-N
XLogP0.76
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide (CID 110848373) is N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide is CC(C)CNC(=O)c1cc(=O)cc[nH]1.
What is the InChIKey of N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide?
The InChIKey is MGLQYVRFPVNUCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7(2)6-12-10(14)9-5-8(13)3-4-11-9/h3-5,7H,6H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide?
N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide has a molecular weight of 194.23 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 110848373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).