2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide

C20H22N4O2S — CID 176646516

IUPAC2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide
SMILESCc1ncc2ccc(-c3cnc(NC(=O)C4C(C)OC(C)C4C)s3)cc2n1
InChIInChI=1S/C20H22N4O2S/c1-10-11(2)26-12(3)18(10)19(25)24-20-22-9-17(27-20)14-5-6-15-8-21-13(4)23-16(15)7-14/h5-12,18H,1-4H3,(H,22,24,25)
InChIKeyCZSKQAOEOJJTNZ-UHFFFAOYSA-N
MW382.49 g/mol
LogP4.06
Rot. Bonds3

About 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide

2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide (PubChem CID 176646516) has the molecular formula C20H22N4O2S and a molecular weight of 382.49 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide.

Molecular Properties

Compound Name2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide
PubChem CID176646516
Molecular FormulaC20H22N4O2S
Molecular Weight382.49 g/mol
Exact Mass382.15
IUPAC Name2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide
SMILESCc1ncc2ccc(-c3cnc(NC(=O)C4C(C)OC(C)C4C)s3)cc2n1
InChIInChI=1S/C20H22N4O2S/c1-10-11(2)26-12(3)18(10)19(25)24-20-22-9-17(27-20)14-5-6-15-8-21-13(4)23-16(15)7-14/h5-12,18H,1-4H3,(H,22,24,25)
InChIKeyCZSKQAOEOJJTNZ-UHFFFAOYSA-N
XLogP4.06
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.49
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3,3-difluoro-N-[7-(1,3-thiazol-5-yl)quinazolin-2-yl]cyclobutane-1-carboxamide
CID 138588538
1-fluoro-N-[7-(1,3-thiazol-5-yl)quinazolin-2-yl]cyclohexane-1-carboxamide
CID 138589506
1-(2,2-difluoropropyl)-N-[7-(1,3-thiazol-5-yl)quinazolin-2-yl]piperidine-4-carboxamide
CID 138589854
4-[(3-fluoroazetidin-1-yl)methyl]-N-[7-(1,3-thiazol-5-yl)quinazolin-2-yl]cyclohexane-1-carboxamide
CID 138590392
N-[5-(3,4-dimethylcinnolin-6-yl)-1,3-thiazol-2-yl]-3-fluorooxolane-3-carboxamide
CID 176146676
N-[5-[3-(difluoromethyl)cinnolin-6-yl]-1,3-thiazol-2-yl]-2,2,5,5-tetramethyloxolane-3-carboxamide
CID 176146684
1-methyl-N-(5-quinazolin-7-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 168925249
Tert-butyl 5-(quinazolin-7-yl)thiazol-2-ylcarbamate
CID 86613780
4-[3-[4-(2-aminopyrimidin-5-yl)phenyl]propoxy]-N-(1,3-benzothiazol-2-yl)butanamide
CID 123604657
4-(hydroxymethyl)-N-[7-(1,3-thiazol-5-yl)quinazolin-2-yl]cyclohexane-1-carboxamide
CID 138587036
N-[7-(2-methyl-1,3-thiazol-5-yl)quinazolin-2-yl]-2-[(1R,4R)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]acetamide
CID 138587299
1-(oxetan-3-yl)-N-[7-(1,3-thiazol-5-yl)quinazolin-2-yl]piperidine-4-carboxamide
CID 138587588

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide?
The IUPAC name of 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide (CID 176646516) is 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide.
What is the SMILES notation for 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide?
The canonical SMILES for 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide is Cc1ncc2ccc(-c3cnc(NC(=O)C4C(C)OC(C)C4C)s3)cc2n1.
What is the InChIKey of 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide?
The InChIKey is CZSKQAOEOJJTNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2S/c1-10-11(2)26-12(3)18(10)19(25)24-20-22-9-17(27-20)14-5-6-15-8-21-13(4)23-16(15)7-14/h5-12,18H,1-4H3,(H,22,24,25).
What are the key properties of 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide?
2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide has a molecular weight of 382.49 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-[5-(2-methylquinazolin-7-yl)-1,3-thiazol-2-yl]oxolane-3-carboxamide is sourced from PubChem (CID 176646516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).