1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide

C18H20N4OS — CID 87039803

IUPAC1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide
SMILESCCn1c(C(=O)Nc2nc3c(s2)CN(C)CC3)cc2ccccc21
InChIInChI=1S/C18H20N4OS/c1-3-22-14-7-5-4-6-12(14)10-15(22)17(23)20-18-19-13-8-9-21(2)11-16(13)24-18/h4-7,10H,3,8-9,11H2,1-2H3,(H,19,20,23)
InChIKeyLGZLZWONEPZVQC-UHFFFAOYSA-N
MW340.45 g/mol
LogP3.36
Rot. Bonds3

About 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide

1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide (PubChem CID 87039803) has the molecular formula C18H20N4OS and a molecular weight of 340.45 g/mol. Its IUPAC name is 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide
PubChem CID87039803
Molecular FormulaC18H20N4OS
Molecular Weight340.45 g/mol
Exact Mass340.14
IUPAC Name1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide
SMILESCCn1c(C(=O)Nc2nc3c(s2)CN(C)CC3)cc2ccccc21
InChIInChI=1S/C18H20N4OS/c1-3-22-14-7-5-4-6-12(14)10-15(22)17(23)20-18-19-13-8-9-21(2)11-16(13)24-18/h4-7,10H,3,8-9,11H2,1-2H3,(H,19,20,23)
InChIKeyLGZLZWONEPZVQC-UHFFFAOYSA-N
XLogP3.36
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-bromo-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide
CID 27421670
4-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)naphthalene-1-carboxamide
CID 167914935
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-2-carboxamide
CID 29173142
4-indol-1-yl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-4-oxobutanamide
CID 84561267
2-methoxy-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide
CID 15282280
1-ethyl-N-(1,3-thiazol-2-yl)indole-2-carboxamide
CID 47335050
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-propyl-1-benzothiophene-2-carboxamide
CID 110503331
4-ethoxy-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;hydrochloride
CID 44827009
3-(dimethylamino)-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide
CID 31617960
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide
CID 27837336
2,4-dichloro-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide
CID 27421659
4-cyano-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;hydrochloride
CID 44826980

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide?
The IUPAC name of 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide (CID 87039803) is 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide.
What is the SMILES notation for 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide?
The canonical SMILES for 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide is CCn1c(C(=O)Nc2nc3c(s2)CN(C)CC3)cc2ccccc21.
What is the InChIKey of 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide?
The InChIKey is LGZLZWONEPZVQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4OS/c1-3-22-14-7-5-4-6-12(14)10-15(22)17(23)20-18-19-13-8-9-21(2)11-16(13)24-18/h4-7,10H,3,8-9,11H2,1-2H3,(H,19,20,23).
What are the key properties of 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide?
1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide has a molecular weight of 340.45 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)indole-2-carboxamide is sourced from PubChem (CID 87039803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).