4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide

C11H14N4OS2 — CID 35936393

IUPAC4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)Nc1nc(C(C)C)cs1
InChIInChI=1S/C11H14N4OS2/c1-4-7-9(18-15-14-7)10(16)13-11-12-8(5-17-11)6(2)3/h5-6H,4H2,1-3H3,(H,12,13,16)
InChIKeyAHODWDWDTWNRBX-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.93
Rot. Bonds4

About 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide

4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide (PubChem CID 35936393) has the molecular formula C11H14N4OS2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide
PubChem CID35936393
Molecular FormulaC11H14N4OS2
Molecular Weight282.39 g/mol
Exact Mass282.06
IUPAC Name4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)Nc1nc(C(C)C)cs1
InChIInChI=1S/C11H14N4OS2/c1-4-7-9(18-15-14-7)10(16)13-11-12-8(5-17-11)6(2)3/h5-6H,4H2,1-3H3,(H,12,13,16)
InChIKeyAHODWDWDTWNRBX-UHFFFAOYSA-N
XLogP2.93
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 2-[2-[(4-ethylthiadiazole-5-carbonyl)amino]-1,3-thiazol-4-yl]acetate
CID 62733826
2-[4-[(4-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]triazol-1-yl]acetic acid
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4-ethyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)thiadiazole-5-carboxamide
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N-[(2S)-1-aminopropan-2-yl]-4-ethylthiadiazole-5-carboxamide;hydrochloride
CID 120505502
4-ethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]thiadiazole-5-carboxamide
CID 37156613
N-(1-cyanoethyl)-4-ethylthiadiazole-5-carboxamide
CID 62046686
methyl N-(4-propan-2-yl-1,3-thiazol-2-yl)carbamate
CID 58913263
5-chloro-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 30715660
4-ethyl-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]thiadiazole-5-carboxamide
CID 134059869
2-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 55115833
N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 63048047
N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide
CID 30796558

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide?
The IUPAC name of 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide (CID 35936393) is 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide.
What is the SMILES notation for 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide?
The canonical SMILES for 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide is CCc1nnsc1C(=O)Nc1nc(C(C)C)cs1.
What is the InChIKey of 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide?
The InChIKey is AHODWDWDTWNRBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS2/c1-4-7-9(18-15-14-7)10(16)13-11-12-8(5-17-11)6(2)3/h5-6H,4H2,1-3H3,(H,12,13,16).
What are the key properties of 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide?
4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide has a molecular weight of 282.39 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide is sourced from PubChem (CID 35936393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).