[3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone

C10H14FN3OS — CID 121021088

IUPAC[3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone
SMILESCCCc1nnsc1C(=O)N1CC(CF)C1
InChIInChI=1S/C10H14FN3OS/c1-2-3-8-9(16-13-12-8)10(15)14-5-7(4-11)6-14/h7H,2-6H2,1H3
InChIKeyVWTBBQLJQJRCTO-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.53
Rot. Bonds4

About [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone

[3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone (PubChem CID 121021088) has the molecular formula C10H14FN3OS and a molecular weight of 243.31 g/mol. Its IUPAC name is [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone.

Molecular Properties

Compound Name[3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone
PubChem CID121021088
Molecular FormulaC10H14FN3OS
Molecular Weight243.31 g/mol
Exact Mass243.08
IUPAC Name[3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone
SMILESCCCc1nnsc1C(=O)N1CC(CF)C1
InChIInChI=1S/C10H14FN3OS/c1-2-3-8-9(16-13-12-8)10(15)14-5-7(4-11)6-14/h7H,2-6H2,1H3
InChIKeyVWTBBQLJQJRCTO-UHFFFAOYSA-N
XLogP1.53
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N,4-triethyl-1,2,3-thiadiazole-5-carboxamide
CID 51073256
(3-(Isobutylsulfonyl)azetidin-1-yl)(4-propyl-1,2,3-thiadiazol-5-yl)methanone
CID 72718966
4-propyl-N-(2,2,2-trifluoroethyl)-1,2,3-thiadiazole-5-carboxamide
CID 45497132
(4-Ethylthiadiazol-5-yl)-[3-(trifluoromethyl)piperidin-1-yl]methanone
CID 45863284
(4-ethylthiadiazol-5-yl)-[(3S)-3-(trifluoromethyl)piperidin-1-yl]methanone
CID 51929052
(4-ethylthiadiazol-5-yl)-[(3R)-3-(trifluoromethyl)piperidin-1-yl]methanone
CID 51929053
2-[(4-Propylthiadiazole-5-carbonyl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79264820
(4-Propyl-1,2,3-thiadiazol-5-yl)(2-(trifluoromethyl)piperidin-1-yl)methanone
CID 92092306
N-(2-hydroxyethyl)-4-propyl-N-(2,2,2-trifluoroethyl)thiadiazole-5-carboxamide
CID 107483362
N-(2-bromoethyl)-N-(2,2-difluoroethyl)-4-propan-2-ylthiadiazole-5-carboxamide
CID 107491726
N-(2-bromoethyl)-N-(2,2-difluoroethyl)-4-ethylthiadiazole-5-carboxamide
CID 107491727
N-(2-chloroethyl)-4-propyl-N-(2,2,2-trifluoroethyl)thiadiazole-5-carboxamide
CID 107491953

Frequently Asked Questions

What is the IUPAC name of [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone?
The IUPAC name of [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone (CID 121021088) is [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone.
What is the SMILES notation for [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone?
The canonical SMILES for [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone is CCCc1nnsc1C(=O)N1CC(CF)C1.
What is the InChIKey of [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone?
The InChIKey is VWTBBQLJQJRCTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3OS/c1-2-3-8-9(16-13-12-8)10(15)14-5-7(4-11)6-14/h7H,2-6H2,1H3.
What are the key properties of [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone?
[3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone has a molecular weight of 243.31 g/mol, XLogP of 1.53, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(fluoromethyl)azetidin-1-yl]-(4-propylthiadiazol-5-yl)methanone is sourced from PubChem (CID 121021088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).