N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide

C5H3F3N2OS — CID 143219890

IUPACN-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide
SMILESO=CNc1nc(C(F)(F)F)cs1
InChIInChI=1S/C5H3F3N2OS/c6-5(7,8)3-1-12-4(10-3)9-2-11/h1-2H,(H,9,10,11)
InChIKeyRVSZNBRWPPQYDW-UHFFFAOYSA-N
MW196.15 g/mol
LogP1.73
Rot. Bonds2

About N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide

N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide (PubChem CID 143219890) has the molecular formula C5H3F3N2OS and a molecular weight of 196.15 g/mol. Its IUPAC name is N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide.

Molecular Properties

Compound NameN-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide
PubChem CID143219890
Molecular FormulaC5H3F3N2OS
Molecular Weight196.15 g/mol
Exact Mass195.99
IUPAC NameN-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide
SMILESO=CNc1nc(C(F)(F)F)cs1
InChIInChI=1S/C5H3F3N2OS/c6-5(7,8)3-1-12-4(10-3)9-2-11/h1-2H,(H,9,10,11)
InChIKeyRVSZNBRWPPQYDW-UHFFFAOYSA-N
XLogP1.73
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.15
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[3-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]formamide
CID 171782810
N-(4-amino-1,3-thiazol-2-yl)formamide
CID 87843150
(2R)-2-[4-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]propanal
CID 87085958
1,1-bis(prop-2-enyl)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]urea
CID 78874535
N-(2-methylphenyl)-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 175598206
4-methoxy-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzenesulfonamide
CID 656127
3-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]carbamoylamino]propanoic acid
CID 122074704
N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazine-2-carboxamide
CID 43068585
N-(1-phenylethyl)-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 53443796
2-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]butan-1-ol
CID 133365985
2-methyl-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propanamide
CID 78863556
4-methylsulfonyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide
CID 78863489

Frequently Asked Questions

What is the IUPAC name of N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide?
The IUPAC name of N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide (CID 143219890) is N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide.
What is the SMILES notation for N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide?
The canonical SMILES for N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide is O=CNc1nc(C(F)(F)F)cs1.
What is the InChIKey of N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide?
The InChIKey is RVSZNBRWPPQYDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3F3N2OS/c6-5(7,8)3-1-12-4(10-3)9-2-11/h1-2H,(H,9,10,11).
What are the key properties of N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide?
N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide has a molecular weight of 196.15 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]formamide is sourced from PubChem (CID 143219890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).