N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide

C15H18N2O2S — CID 6457482

IUPACN-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide
SMILESCc1nc(NC(=O)c2cccc(OC(C)C)c2)sc1C
InChIInChI=1S/C15H18N2O2S/c1-9(2)19-13-7-5-6-12(8-13)14(18)17-15-16-10(3)11(4)20-15/h5-9H,1-4H3,(H,16,17,18)
InChIKeyXYNLUWWGENTJTN-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.80
Rot. Bonds4

About N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide

N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide (PubChem CID 6457482) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide
PubChem CID6457482
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide
SMILESCc1nc(NC(=O)c2cccc(OC(C)C)c2)sc1C
InChIInChI=1S/C15H18N2O2S/c1-9(2)19-13-7-5-6-12(8-13)14(18)17-15-16-10(3)11(4)20-15/h5-9H,1-4H3,(H,16,17,18)
InChIKeyXYNLUWWGENTJTN-UHFFFAOYSA-N
XLogP3.80
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-propan-2-yloxybenzamide
CID 17100977
methyl 2-[(3-propan-2-yloxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate
CID 17128823
(2R)-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(3-methylphenoxy)propanamide
CID 8797574
N-(4,5-dimethyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 693380
N-(4,5-dimethyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;hydrochloride
CID 110756954
3-[3-[(4,5-dimethyl-1,3-thiazol-2-yl)carbamoyl]phenyl]prop-2-enoic acid
CID 76906990
propan-2-yl 4-methyl-2-[(3-methylbenzoyl)amino]-1,3-thiazole-5-carboxylate
CID 110441431
N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide
CID 18084540
N-propan-2-yl-3-propan-2-yloxybenzamide
CID 8779048
N-(4,5-dimethyl-1,3-thiazol-2-yl)-5-methylthiophene-3-carboxamide
CID 17191166
N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 31154524
N-(6-morpholin-4-yl-1,3-benzothiazol-2-yl)-3-propan-2-yloxybenzamide
CID 40604029

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide?
The IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide (CID 6457482) is N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide is Cc1nc(NC(=O)c2cccc(OC(C)C)c2)sc1C.
What is the InChIKey of N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide?
The InChIKey is XYNLUWWGENTJTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-9(2)19-13-7-5-6-12(8-13)14(18)17-15-16-10(3)11(4)20-15/h5-9H,1-4H3,(H,16,17,18).
What are the key properties of N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide?
N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide has a molecular weight of 290.39 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-propan-2-yloxybenzamide is sourced from PubChem (CID 6457482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).