N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine

C10H11FN2S — CID 12623045

IUPACN-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESFc1cccc(CNC2=NCCS2)c1
InChIInChI=1S/C10H11FN2S/c11-9-3-1-2-8(6-9)7-13-10-12-4-5-14-10/h1-3,6H,4-5,7H2,(H,12,13)
InChIKeyRUGKQXUKIAVTSN-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.02
Rot. Bonds2

About N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine

N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 12623045) has the molecular formula C10H11FN2S and a molecular weight of 210.28 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID12623045
Molecular FormulaC10H11FN2S
Molecular Weight210.28 g/mol
Exact Mass210.06
IUPAC NameN-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESFc1cccc(CNC2=NCCS2)c1
InChIInChI=1S/C10H11FN2S/c11-9-3-1-2-8(6-9)7-13-10-12-4-5-14-10/h1-3,6H,4-5,7H2,(H,12,13)
InChIKeyRUGKQXUKIAVTSN-UHFFFAOYSA-N
XLogP2.02
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-bromo-5-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 50913562
N-[1-(2,3-dimethylphenyl)-2-(3-fluorophenyl)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 25002547
N-[(3-bromo-2-fluoro-5-methylphenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 50913703
N-[(3-fluorophenyl)methyl]-4-methylaniline
CID 23255338
2-N-ethyl-6-N-[(3-fluorophenyl)methyl]pyridine-2,6-diamine
CID 80771478
2-[(3-fluorophenyl)methylamino]-1,3-thiazole-5-carboxylic acid
CID 80571876
2-fluoro-N-[(3-fluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 118240606
1-(3-fluorophenyl)-N-methylmethanamine;methane
CID 144941396
2-chloro-5-fluoro-N-[(3-fluorophenyl)methyl]pyrimidin-4-amine
CID 79080713
N-[(3-fluorophenyl)methyl]-3-iodoaniline
CID 28879212
2-N-[(3-fluorophenyl)methyl]benzene-1,2-diamine
CID 28970511
6-bromo-N-[(3-fluorophenyl)methyl]-1,3-benzothiazol-2-amine
CID 79533816

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine (CID 12623045) is N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine is Fc1cccc(CNC2=NCCS2)c1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is RUGKQXUKIAVTSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2S/c11-9-3-1-2-8(6-9)7-13-10-12-4-5-14-10/h1-3,6H,4-5,7H2,(H,12,13).
What are the key properties of N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine?
N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 210.28 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 12623045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).