N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide

C12H16N2O2 — CID 103762881

IUPACN-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cc[nH]c(=O)c1
InChIInChI=1S/C12H16N2O2/c1-8(9-3-4-9)14(2)12(16)10-5-6-13-11(15)7-10/h5-9H,3-4H2,1-2H3,(H,13,15)
InChIKeyDSPXKDVWSZWYHW-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.25
Rot. Bonds3

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

N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 103762881) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide
PubChem CID103762881
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cc[nH]c(=O)c1
InChIInChI=1S/C12H16N2O2/c1-8(9-3-4-9)14(2)12(16)10-5-6-13-11(15)7-10/h5-9H,3-4H2,1-2H3,(H,13,15)
InChIKeyDSPXKDVWSZWYHW-UHFFFAOYSA-N
XLogP1.25
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide (CID 103762881) is N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide is CC(C1CC1)N(C)C(=O)c1cc[nH]c(=O)c1.
What is the InChIKey of N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is DSPXKDVWSZWYHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-8(9-3-4-9)14(2)12(16)10-5-6-13-11(15)7-10/h5-9H,3-4H2,1-2H3,(H,13,15).
What are the key properties of N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide?
N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 220.27 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103762881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).