1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one

C10H12N4OS — CID 62208485

IUPAC1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one
SMILESCCNc1snnc1Cn1ccccc1=O
InChIInChI=1S/C10H12N4OS/c1-2-11-10-8(12-13-16-10)7-14-6-4-3-5-9(14)15/h3-6,11H,2,7H2,1H3
InChIKeyTUPPNUAPWXWTPX-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.18
Rot. Bonds4

About 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one

1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one (PubChem CID 62208485) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one.

Molecular Properties

Compound Name1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one
PubChem CID62208485
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one
SMILESCCNc1snnc1Cn1ccccc1=O
InChIInChI=1S/C10H12N4OS/c1-2-11-10-8(12-13-16-10)7-14-6-4-3-5-9(14)15/h3-6,11H,2,7H2,1H3
InChIKeyTUPPNUAPWXWTPX-UHFFFAOYSA-N
XLogP1.18
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[[5-(Methylamino)thiadiazol-4-yl]methyl]-5-(trifluoromethyl)pyridin-2-one
CID 55171482
1-[[5-(Ethylamino)thiadiazol-4-yl]methyl]-5-(trifluoromethyl)pyridin-2-one
CID 63280256
1-[[5-(Propylamino)thiadiazol-4-yl]methyl]-5-(trifluoromethyl)pyridin-2-one
CID 63280257
1-[[5-(Propylamino)thiadiazol-4-yl]methyl]-6-(trifluoromethyl)pyridin-2-one
CID 81310736
1-[[5-(Ethylamino)thiadiazol-4-yl]methyl]-6-(trifluoromethyl)pyridin-2-one
CID 81318910
1-[(5-Aminothiadiazol-4-yl)methyl]-6-(trifluoromethyl)pyridin-2-one
CID 81319538
1-[[5-(Methylamino)thiadiazol-4-yl]methyl]-6-(trifluoromethyl)pyridin-2-one
CID 81319668
1-Propyl-5-(thiadiazol-4-ylmethylamino)pyridin-2-one
CID 54863795
3-[[5-(Ethylamino)thiadiazol-4-yl]methyl]-6-methylpyrimidin-4-one
CID 55044777
5-Bromo-1-[[5-(methylamino)thiadiazol-4-yl]methyl]-3-nitropyridin-2-one
CID 55044871
2-[[5-(ethylamino)thiadiazol-4-yl]methyl]-1H-pyridazine-3,6-dione
CID 55046242
1-[[5-(Methylamino)thiadiazol-4-yl]methyl]-5-nitropyridin-2-one
CID 55046625

Frequently Asked Questions

What is the IUPAC name of 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one?
The IUPAC name of 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one (CID 62208485) is 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one.
What is the SMILES notation for 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one?
The canonical SMILES for 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one is CCNc1snnc1Cn1ccccc1=O.
What is the InChIKey of 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one?
The InChIKey is TUPPNUAPWXWTPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-2-11-10-8(12-13-16-10)7-14-6-4-3-5-9(14)15/h3-6,11H,2,7H2,1H3.
What are the key properties of 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one?
1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one has a molecular weight of 236.30 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]pyridin-2-one is sourced from PubChem (CID 62208485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).