6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide

C20H21N3O3 — CID 42628942

IUPAC6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide
SMILESCc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC(C)C)cn1
InChIInChI=1S/C20H21N3O3/c1-13(2)22-20(24)16-9-10-18(21-11-16)25-12-17-14(3)26-23-19(17)15-7-5-4-6-8-15/h4-11,13H,12H2,1-3H3,(H,22,24)
InChIKeyZECHOCFAIQZSIQ-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.76
Rot. Bonds6

About 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide

6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide (PubChem CID 42628942) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide
PubChem CID42628942
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide
SMILESCc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC(C)C)cn1
InChIInChI=1S/C20H21N3O3/c1-13(2)22-20(24)16-9-10-18(21-11-16)25-12-17-14(3)26-23-19(17)15-7-5-4-6-8-15/h4-11,13H,12H2,1-3H3,(H,22,24)
InChIKeyZECHOCFAIQZSIQ-UHFFFAOYSA-N
XLogP3.76
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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Alogabat
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Mmpip
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ML381
CID 42519285
6-[[5-methyl-3-(6-methylpyridin-3-yl)-1,2-oxazol-4-yl]methoxy]-~{N}-[(2~{S})-1-oxidanylpentan-2-yl]pyridine-3-carboxamide
CID 134604371
2-[5-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl N-phenylcarbamate
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CID 71455447
2-[5-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl N-ethylcarbamate
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6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-3,4-dihydro-2H-2,7-naphthyridin-1-one
CID 168284772
2-ethoxy-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 4794993
2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 9113215
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(3-methyl-2-pyridinyl)benzamide
CID 16351001

Frequently Asked Questions

What is the IUPAC name of 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide (CID 42628942) is 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide is Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC(C)C)cn1.
What is the InChIKey of 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide?
The InChIKey is ZECHOCFAIQZSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-13(2)22-20(24)16-9-10-18(21-11-16)25-12-17-14(3)26-23-19(17)15-7-5-4-6-8-15/h4-11,13H,12H2,1-3H3,(H,22,24).
What are the key properties of 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide?
6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 3.76, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 42628942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).