1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide

C5H7N5OS — CID 114912521

IUPAC1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide
SMILESNC1(C(=O)Nc2nnns2)CC1
InChIInChI=1S/C5H7N5OS/c6-5(1-2-5)3(11)7-4-8-9-10-12-4/h1-2,6H2,(H,7,8,10,11)
InChIKeySHYHMJQKLFYRST-UHFFFAOYSA-N
MW185.21 g/mol
LogP-0.64
Rot. Bonds2

About 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide

1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide (PubChem CID 114912521) has the molecular formula C5H7N5OS and a molecular weight of 185.21 g/mol. Its IUPAC name is 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide
PubChem CID114912521
Molecular FormulaC5H7N5OS
Molecular Weight185.21 g/mol
Exact Mass185.04
IUPAC Name1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide
SMILESNC1(C(=O)Nc2nnns2)CC1
InChIInChI=1S/C5H7N5OS/c6-5(1-2-5)3(11)7-4-8-9-10-12-4/h1-2,6H2,(H,7,8,10,11)
InChIKeySHYHMJQKLFYRST-UHFFFAOYSA-N
XLogP-0.64
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.21
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-carbamothioyl-N-(thiatriazol-5-yl)cyclobutane-1-carboxamide
CID 114912668
1-carbamothioyl-N-(thiatriazol-5-yl)cyclopentane-1-carboxamide
CID 114912682
1-amino-N-(thiadiazol-4-yl)cyclopropane-1-carboxamide
CID 164646382
2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide
CID 114912485
1-amino-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide;hydrochloride
CID 119705865
2-propyl-N-(thiatriazol-5-yl)pyrrolidine-2-carboxamide
CID 106975887
(2S)-2-amino-N-(thiatriazol-5-yl)propanamide
CID 104982976
3-amino-N-(thiatriazol-5-yl)cyclopentane-1-carboxamide
CID 114912547
N-(thiatriazol-5-yl)azetidine-2-carboxamide
CID 127007602
3-amino-2-methyl-3-sulfanylidene-N-(thiatriazol-5-yl)propanamide
CID 114912683
1-amino-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide
CID 119674558
1-amino-N-(thiadiazol-5-yl)cyclobutane-1-carboxamide
CID 114912192

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide (CID 114912521) is 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide is NC1(C(=O)Nc2nnns2)CC1.
What is the InChIKey of 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide?
The InChIKey is SHYHMJQKLFYRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N5OS/c6-5(1-2-5)3(11)7-4-8-9-10-12-4/h1-2,6H2,(H,7,8,10,11).
What are the key properties of 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide?
1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide has a molecular weight of 185.21 g/mol, XLogP of -0.64, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(thiatriazol-5-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 114912521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).