N-(1,3-thiazol-2-yl)cyclopropanecarboxamide

C7H8N2OS — CID 923384

IUPACN-(1,3-thiazol-2-yl)cyclopropanecarboxamide
SMILESO=C(Nc1nccs1)C1CC1
InChIInChI=1S/C7H8N2OS/c10-6(5-1-2-5)9-7-8-3-4-11-7/h3-5H,1-2H2,(H,8,9,10)
InChIKeyJXLKHZWUKANKPW-UHFFFAOYSA-N
MW168.22 g/mol
LogP1.49
Rot. Bonds2

About N-(1,3-thiazol-2-yl)cyclopropanecarboxamide

N-(1,3-thiazol-2-yl)cyclopropanecarboxamide (PubChem CID 923384) has the molecular formula C7H8N2OS and a molecular weight of 168.22 g/mol. Its IUPAC name is N-(1,3-thiazol-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(1,3-thiazol-2-yl)cyclopropanecarboxamide
PubChem CID923384
Molecular FormulaC7H8N2OS
Molecular Weight168.22 g/mol
Exact Mass168.04
IUPAC NameN-(1,3-thiazol-2-yl)cyclopropanecarboxamide
SMILESO=C(Nc1nccs1)C1CC1
InChIInChI=1S/C7H8N2OS/c10-6(5-1-2-5)9-7-8-3-4-11-7/h3-5H,1-2H2,(H,8,9,10)
InChIKeyJXLKHZWUKANKPW-UHFFFAOYSA-N
XLogP1.49
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Acetamidothiazole
CID 17625
3-Oxo-N-2-thiazolylbutanamide
CID 12811
2,2-Dibromo-1-methyl-N-(1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 592926
N-Thiazol-2-yl-succinamic acid
CID 255363
2-cyano-N-(1,3-thiazol-2-yl)acetamide
CID 693166
2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide
CID 2834959
2-cyclopentyl-N-(1,3-thiazol-2-yl)acetamide
CID 2666601
N-(1,3-thiazol-2-yl)-2,2-bis(trifluoromethyl)butanamide
CID 658974
3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide
CID 711478
1-Propyl-3-(1,3-thiazol-2-yl)urea
CID 2130249
3-chloro-N-2-thiazolyl-Propanamide
CID 567762
2-methyl-N-(1,3-thiazol-2-yl)butanamide
CID 3140495

Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(1,3-thiazol-2-yl)cyclopropanecarboxamide (CID 923384) is N-(1,3-thiazol-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(1,3-thiazol-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(1,3-thiazol-2-yl)cyclopropanecarboxamide is O=C(Nc1nccs1)C1CC1.
What is the InChIKey of N-(1,3-thiazol-2-yl)cyclopropanecarboxamide?
The InChIKey is JXLKHZWUKANKPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2OS/c10-6(5-1-2-5)9-7-8-3-4-11-7/h3-5H,1-2H2,(H,8,9,10).
What are the key properties of N-(1,3-thiazol-2-yl)cyclopropanecarboxamide?
N-(1,3-thiazol-2-yl)cyclopropanecarboxamide has a molecular weight of 168.22 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 923384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).