N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide

C16H17N3O3 — CID 138041610

IUPACN-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
SMILESCNC(=O)C(C)NC(=O)c1ccc(-c2ccccc2)[nH]c1=O
InChIInChI=1S/C16H17N3O3/c1-10(14(20)17-2)18-15(21)12-8-9-13(19-16(12)22)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,20)(H,18,21)(H,19,22)
InChIKeyXOTRLBBBYXKFHN-UHFFFAOYSA-N
MW299.33 g/mol
LogP0.91
Rot. Bonds4

About N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide

N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide (PubChem CID 138041610) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
PubChem CID138041610
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC NameN-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
SMILESCNC(=O)C(C)NC(=O)c1ccc(-c2ccccc2)[nH]c1=O
InChIInChI=1S/C16H17N3O3/c1-10(14(20)17-2)18-15(21)12-8-9-13(19-16(12)22)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,20)(H,18,21)(H,19,22)
InChIKeyXOTRLBBBYXKFHN-UHFFFAOYSA-N
XLogP0.91
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 50.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The IUPAC name of N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide (CID 138041610) is N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide is CNC(=O)C(C)NC(=O)c1ccc(-c2ccccc2)[nH]c1=O.
What is the InChIKey of N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The InChIKey is XOTRLBBBYXKFHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-10(14(20)17-2)18-15(21)12-8-9-13(19-16(12)22)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,20)(H,18,21)(H,19,22).
What are the key properties of N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 0.91, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 138041610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).