N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide

C14H15N3O2 — CID 117062774

IUPACN-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide
SMILESCc1ccc(NC(=O)C2CC2)c(-c2nc(C)no2)c1
InChIInChI=1S/C14H15N3O2/c1-8-3-6-12(16-13(18)10-4-5-10)11(7-8)14-15-9(2)17-19-14/h3,6-7,10H,4-5H2,1-2H3,(H,16,18)
InChIKeyGBAKBQUZIDPBAW-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.70
Rot. Bonds3

About N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide

N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide (PubChem CID 117062774) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide
PubChem CID117062774
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide
SMILESCc1ccc(NC(=O)C2CC2)c(-c2nc(C)no2)c1
InChIInChI=1S/C14H15N3O2/c1-8-3-6-12(16-13(18)10-4-5-10)11(7-8)14-15-9(2)17-19-14/h3,6-7,10H,4-5H2,1-2H3,(H,16,18)
InChIKeyGBAKBQUZIDPBAW-UHFFFAOYSA-N
XLogP2.70
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethylphenyl)cyclopropanecarboxamide
CID 5066654
N-(2-chloro-5-methylphenyl)cyclopropanecarboxamide
CID 70795609
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]piperidine-2-carboxamide
CID 43701124
N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]cyclopropanecarboxamide
CID 4670180
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 46266860
4-N-tert-butyl-1-N-(2,4-dimethylphenyl)cyclohexane-1,4-dicarboxamide
CID 109149567
N-(2,4-dimethylphenyl)-4-(4-ethylcyclohexyl)cyclohexane-1-carboxamide
CID 157168995
1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]-N-(5-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 133319012
N-(2-bromo-4-methylphenyl)cyclohexanecarboxamide
CID 3728666
5-methyl-2-(thiane-4-carbonylamino)benzoic acid
CID 120537831
2-[[1-(4,6-dimethylpyrimidin-2-yl)piperidine-4-carbonyl]amino]-5-methylbenzoic acid
CID 108805793
N-(2-hydroxy-5-methylphenyl)cyclopentanecarboxamide
CID 1234653

Frequently Asked Questions

What is the IUPAC name of N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide (CID 117062774) is N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide is Cc1ccc(NC(=O)C2CC2)c(-c2nc(C)no2)c1.
What is the InChIKey of N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide?
The InChIKey is GBAKBQUZIDPBAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-8-3-6-12(16-13(18)10-4-5-10)11(7-8)14-15-9(2)17-19-14/h3,6-7,10H,4-5H2,1-2H3,(H,16,18).
What are the key properties of N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide?
N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 117062774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).