5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide

C15H15N5O3 — CID 70740997

IUPAC5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide
SMILESCCc1ocnc1C(=O)N(C)Cc1nc(-c2ccccn2)no1
InChIInChI=1S/C15H15N5O3/c1-3-11-13(17-9-22-11)15(21)20(2)8-12-18-14(19-23-12)10-6-4-5-7-16-10/h4-7,9H,3,8H2,1-2H3
InChIKeyMVWRTPKTPXAUKL-UHFFFAOYSA-N
MW313.32 g/mol
LogP1.95
Rot. Bonds5

About 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide

5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide (PubChem CID 70740997) has the molecular formula C15H15N5O3 and a molecular weight of 313.32 g/mol. Its IUPAC name is 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide
PubChem CID70740997
Molecular FormulaC15H15N5O3
Molecular Weight313.32 g/mol
Exact Mass313.12
IUPAC Name5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide
SMILESCCc1ocnc1C(=O)N(C)Cc1nc(-c2ccccn2)no1
InChIInChI=1S/C15H15N5O3/c1-3-11-13(17-9-22-11)15(21)20(2)8-12-18-14(19-23-12)10-6-4-5-7-16-10/h4-7,9H,3,8H2,1-2H3
InChIKeyMVWRTPKTPXAUKL-UHFFFAOYSA-N
XLogP1.95
TPSA98.15 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.32
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

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4-acetamido-2-chloro-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]benzamide
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(2S)-N-methyl-2-(2-propylbenzimidazol-1-yl)-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]propanamide
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5-butyl-3-pyridin-2-yl-1,2,4-oxadiazole
CID 26772271
methyl 2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)acetate
CID 79474815
1,1,1-trifluoro-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-one
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N-methyl-2-(3-phenylpyrrolidin-1-yl)-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
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N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-ethyl-1,3-oxazole-4-carboxamide
CID 28730312

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide (CID 70740997) is 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide is CCc1ocnc1C(=O)N(C)Cc1nc(-c2ccccn2)no1.
What is the InChIKey of 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is MVWRTPKTPXAUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O3/c1-3-11-13(17-9-22-11)15(21)20(2)8-12-18-14(19-23-12)10-6-4-5-7-16-10/h4-7,9H,3,8H2,1-2H3.
What are the key properties of 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide?
5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 313.32 g/mol, XLogP of 1.95, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 70740997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).