N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide

C17H18N4O2 — CID 155910477

IUPACN-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide
SMILESCc1cc(C)n(-c2cccc(C(=O)Nc3onc(C)c3C)c2)n1
InChIInChI=1S/C17H18N4O2/c1-10-8-11(2)21(19-10)15-7-5-6-14(9-15)16(22)18-17-12(3)13(4)20-23-17/h5-9H,1-4H3,(H,18,22)
InChIKeySUPAVHNMSRVOAZ-UHFFFAOYSA-N
MW310.36 g/mol
LogP3.35
Rot. Bonds3

About N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide

N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide (PubChem CID 155910477) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide
PubChem CID155910477
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide
SMILESCc1cc(C)n(-c2cccc(C(=O)Nc3onc(C)c3C)c2)n1
InChIInChI=1S/C17H18N4O2/c1-10-8-11(2)21(19-10)15-7-5-6-14(9-15)16(22)18-17-12(3)13(4)20-23-17/h5-9H,1-4H3,(H,18,22)
InChIKeySUPAVHNMSRVOAZ-UHFFFAOYSA-N
XLogP3.35
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 58656859
CID 58656859
3-[(3,4-dimethyl-1,2-oxazol-5-yl)carbamoyl]benzoic acid
CID 65482154
N-(1,3-benzodioxol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide
CID 71707580
3-[3-[(3,4-dimethyl-1,2-oxazol-5-yl)carbamoyl]phenyl]prop-2-enoic acid
CID 77070299
N-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide
CID 155919058
3-[[3-(3,5-dimethylpyrazol-1-yl)benzoyl]amino]-N-(2-methoxyethyl)-2-methylbenzamide
CID 131921932
N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methyl-4-(methylamino)benzamide
CID 65480384
3-(3,5-dimethylpyrazol-1-yl)-N-(2-methylsulfonylethyl)benzamide
CID 72859306
N-(1-carbamoylcyclopentyl)-3-(3,5-dimethylpyrazol-1-yl)benzamide
CID 72914025
methyl 3-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-3-oxopropanoate
CID 156788382
N-(1-carbamoylcyclohexyl)-3-(3,5-dimethylpyrazol-1-yl)benzamide
CID 72875646
ethyl 3-(3,5-dimethylpyrazol-1-yl)benzoate
CID 50883494

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide?
The IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide (CID 155910477) is N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide.
What is the SMILES notation for N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide?
The canonical SMILES for N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide is Cc1cc(C)n(-c2cccc(C(=O)Nc3onc(C)c3C)c2)n1.
What is the InChIKey of N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide?
The InChIKey is SUPAVHNMSRVOAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-10-8-11(2)21(19-10)15-7-5-6-14(9-15)16(22)18-17-12(3)13(4)20-23-17/h5-9H,1-4H3,(H,18,22).
What are the key properties of N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide?
N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide has a molecular weight of 310.36 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(3,5-dimethylpyrazol-1-yl)benzamide is sourced from PubChem (CID 155910477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).