N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide

C14H18N4O3 — CID 157011420

IUPACN-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
SMILESCC(C)c1[nH]c(=O)ccc1C(=O)N(C)CCc1ncon1
InChIInChI=1S/C14H18N4O3/c1-9(2)13-10(4-5-12(19)16-13)14(20)18(3)7-6-11-15-8-21-17-11/h4-5,8-9H,6-7H2,1-3H3,(H,16,19)
InChIKeySRHGKDGCHTVZBN-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.20
Rot. Bonds5

About N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide

N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide (PubChem CID 157011420) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
PubChem CID157011420
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC NameN-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
SMILESCC(C)c1[nH]c(=O)ccc1C(=O)N(C)CCc1ncon1
InChIInChI=1S/C14H18N4O3/c1-9(2)13-10(4-5-12(19)16-13)14(20)18(3)7-6-11-15-8-21-17-11/h4-5,8-9H,6-7H2,1-3H3,(H,16,19)
InChIKeySRHGKDGCHTVZBN-UHFFFAOYSA-N
XLogP1.20
TPSA92.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide?
The IUPAC name of N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide (CID 157011420) is N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide?
The canonical SMILES for N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide is CC(C)c1[nH]c(=O)ccc1C(=O)N(C)CCc1ncon1.
What is the InChIKey of N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide?
The InChIKey is SRHGKDGCHTVZBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-9(2)13-10(4-5-12(19)16-13)14(20)18(3)7-6-11-15-8-21-17-11/h4-5,8-9H,6-7H2,1-3H3,(H,16,19).
What are the key properties of N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide?
N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide has a molecular weight of 290.32 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 157011420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).