3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide

C19H24N4O2S — CID 46523320

IUPAC3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide
SMILESCC(=O)NC(CC(=O)Nc1nc2c(s1)CN(C)CC2)c1ccc(C)cc1
InChIInChI=1S/C19H24N4O2S/c1-12-4-6-14(7-5-12)16(20-13(2)24)10-18(25)22-19-21-15-8-9-23(3)11-17(15)26-19/h4-7,16H,8-11H2,1-3H3,(H,20,24)(H,21,22,25)
InChIKeyCGAGIQCZQMDTLX-UHFFFAOYSA-N
MW372.49 g/mol
LogP2.65
Rot. Bonds5

About 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide

3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide (PubChem CID 46523320) has the molecular formula C19H24N4O2S and a molecular weight of 372.49 g/mol. Its IUPAC name is 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide.

Molecular Properties

Compound Name3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide
PubChem CID46523320
Molecular FormulaC19H24N4O2S
Molecular Weight372.49 g/mol
Exact Mass372.16
IUPAC Name3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide
SMILESCC(=O)NC(CC(=O)Nc1nc2c(s1)CN(C)CC2)c1ccc(C)cc1
InChIInChI=1S/C19H24N4O2S/c1-12-4-6-14(7-5-12)16(20-13(2)24)10-18(25)22-19-21-15-8-9-23(3)11-17(15)26-19/h4-7,16H,8-11H2,1-3H3,(H,20,24)(H,21,22,25)
InChIKeyCGAGIQCZQMDTLX-UHFFFAOYSA-N
XLogP2.65
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 39177210
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 35978089
3-acetamido-3-(4-methylphenyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)propanamide
CID 51315681
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-(3-methylphenoxy)acetamide
CID 51172739
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-morpholin-4-ylacetamide
CID 110444203
3-methoxy-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)propanamide
CID 110480434
4-amino-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)butanamide
CID 39177041
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide
CID 31246798
3-acetamido-3-(4-methoxyphenyl)-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]propanamide
CID 134011351
methyl 2-[2-[[3-acetamido-3-(4-methylphenyl)propanoyl]amino]-1,3-thiazol-4-yl]acetate
CID 46432778
2-(8-chloronaphthalen-1-yl)sulfanyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 31245977
2-amino-2-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)propanamide
CID 110460913

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide?
The IUPAC name of 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide (CID 46523320) is 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide.
What is the SMILES notation for 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide?
The canonical SMILES for 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide is CC(=O)NC(CC(=O)Nc1nc2c(s1)CN(C)CC2)c1ccc(C)cc1.
What is the InChIKey of 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide?
The InChIKey is CGAGIQCZQMDTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2S/c1-12-4-6-14(7-5-12)16(20-13(2)24)10-18(25)22-19-21-15-8-9-23(3)11-17(15)26-19/h4-7,16H,8-11H2,1-3H3,(H,20,24)(H,21,22,25).
What are the key properties of 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide?
3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide has a molecular weight of 372.49 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide is sourced from PubChem (CID 46523320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).