4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole

C7H8FNS — CID 146290322

IUPAC4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole
SMILESCc1nc(C2(F)CC2)cs1
InChIInChI=1S/C7H8FNS/c1-5-9-6(4-10-5)7(8)2-3-7/h4H,2-3H2,1H3
InChIKeyIIKYUUMJQWDVDA-UHFFFAOYSA-N
MW157.21 g/mol
LogP2.41
Rot. Bonds1

About 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole

4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole (PubChem CID 146290322) has the molecular formula C7H8FNS and a molecular weight of 157.21 g/mol. Its IUPAC name is 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole.

Molecular Properties

Compound Name4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole
PubChem CID146290322
Molecular FormulaC7H8FNS
Molecular Weight157.21 g/mol
Exact Mass157.04
IUPAC Name4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole
SMILESCc1nc(C2(F)CC2)cs1
InChIInChI=1S/C7H8FNS/c1-5-9-6(4-10-5)7(8)2-3-7/h4H,2-3H2,1H3
InChIKeyIIKYUUMJQWDVDA-UHFFFAOYSA-N
XLogP2.41
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Ethyl-2-methylthiazole
CID 520568
2,4-Diethylthiazole
CID 122576
2-Methyl-4-(1-methylethyl)thiazole
CID 520569
4-Ethyl-2-propylthiazole
CID 521078
2-Ethyl-4-propylthiazole
CID 53754611
4-Butyl-2-methylthiazole
CID 574804
2,4-Dipropylthiazole
CID 588182
2-Butyl-4-propylthiazole
CID 55295885
2-(1-Methylethyl)-4-propylthiazole
CID 54281113
2-Methyl-4-propylthiazole
CID 39071
(4-Cyclopropyl-1,3-thiazol-2-yl)methanamine
CID 3896896
4-Cyclopropyl-2-ethynyl-1,3-thiazole
CID 45079394

Frequently Asked Questions

What is the IUPAC name of 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole?
The IUPAC name of 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole (CID 146290322) is 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole.
What is the SMILES notation for 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole?
The canonical SMILES for 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole is Cc1nc(C2(F)CC2)cs1.
What is the InChIKey of 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole?
The InChIKey is IIKYUUMJQWDVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNS/c1-5-9-6(4-10-5)7(8)2-3-7/h4H,2-3H2,1H3.
What are the key properties of 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole?
4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole has a molecular weight of 157.21 g/mol, XLogP of 2.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-fluorocyclopropyl)-2-methyl-1,3-thiazole is sourced from PubChem (CID 146290322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).