2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide

C5H9N5OS — CID 114912485

IUPAC2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide
SMILESCC(C)(N)C(=O)Nc1nnns1
InChIInChI=1S/C5H9N5OS/c1-5(2,6)3(11)7-4-8-9-10-12-4/h6H2,1-2H3,(H,7,8,10,11)
InChIKeyPZASGHPVYRZTFL-UHFFFAOYSA-N
MW187.23 g/mol
LogP-0.39
Rot. Bonds2

About 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide

2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide (PubChem CID 114912485) has the molecular formula C5H9N5OS and a molecular weight of 187.23 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide
PubChem CID114912485
Molecular FormulaC5H9N5OS
Molecular Weight187.23 g/mol
Exact Mass187.05
IUPAC Name2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide
SMILESCC(C)(N)C(=O)Nc1nnns1
InChIInChI=1S/C5H9N5OS/c1-5(2,6)3(11)7-4-8-9-10-12-4/h6H2,1-2H3,(H,7,8,10,11)
InChIKeyPZASGHPVYRZTFL-UHFFFAOYSA-N
XLogP-0.39
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.23
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
CID 119265894
(2S)-2-amino-N-(thiatriazol-5-yl)propanamide
CID 104982976
4-tert-butyl-N-(thiatriazol-5-yl)benzamide
CID 19114244
2-methyl-1-N-(thiatriazol-5-yl)propane-1,2-diamine
CID 117044430
3-amino-2-methyl-3-sulfanylidene-N-(thiatriazol-5-yl)propanamide
CID 114912683
2-amino-2-methyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide;hydrochloride
CID 119279554
(2R)-2-amino-N-(thiatriazol-5-yl)butanamide
CID 104982974
1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide
CID 114912521
N-prop-1-en-2-ylthiatriazol-5-amine
CID 163890294
(2R)-2-amino-N-(thiatriazol-5-yl)pentanamide
CID 107570824
2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-methylpropanamide;hydrochloride
CID 119295888
2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
CID 119270517

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide?
The IUPAC name of 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide (CID 114912485) is 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide?
The canonical SMILES for 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide is CC(C)(N)C(=O)Nc1nnns1.
What is the InChIKey of 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide?
The InChIKey is PZASGHPVYRZTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N5OS/c1-5(2,6)3(11)7-4-8-9-10-12-4/h6H2,1-2H3,(H,7,8,10,11).
What are the key properties of 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide?
2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide has a molecular weight of 187.23 g/mol, XLogP of -0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide is sourced from PubChem (CID 114912485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).