[1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine

C14H15FN2S — CID 116969377

IUPAC[1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine
SMILESNCC1(Cc2nc(-c3ccccc3F)cs2)CC1
InChIInChI=1S/C14H15FN2S/c15-11-4-2-1-3-10(11)12-8-18-13(17-12)7-14(9-16)5-6-14/h1-4,8H,5-7,9,16H2
InChIKeyWAVMTVRWENRPAG-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.23
Rot. Bonds4

About [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine

[1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine (PubChem CID 116969377) has the molecular formula C14H15FN2S and a molecular weight of 262.35 g/mol. Its IUPAC name is [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine
PubChem CID116969377
Molecular FormulaC14H15FN2S
Molecular Weight262.35 g/mol
Exact Mass262.09
IUPAC Name[1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine
SMILESNCC1(Cc2nc(-c3ccccc3F)cs2)CC1
InChIInChI=1S/C14H15FN2S/c15-11-4-2-1-3-10(11)12-8-18-13(17-12)7-14(9-16)5-6-14/h1-4,8H,5-7,9,16H2
InChIKeyWAVMTVRWENRPAG-UHFFFAOYSA-N
XLogP3.23
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine with MolForge

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Related Compounds

2-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]ethanamine;hydrobromide
CID 127046715
4-(2-fluorophenyl)-2-(2,2,2-trifluoroethyl)-1,3-thiazole
CID 116969906
1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]butan-2-amine
CID 62647488
1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclopentan-1-amine;hydrochloride
CID 120558260
[1-[(2-fluorophenyl)methyl]cyclopropyl]methanamine
CID 66024201
[1-[(4-cyclobutyl-1,3-thiazol-2-yl)methyl]cyclopropyl]methanamine
CID 116969391
[1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol
CID 116865623
[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl-methylcarbamic acid
CID 68925488
2-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]ethylcarbamic acid
CID 68925492
[3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)methyl]oxetan-3-yl]methanamine
CID 116969581
1-(cyclobutylmethyl)-2-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]guanidine
CID 120603174
3-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]propan-1-amine
CID 62666679

Frequently Asked Questions

What is the IUPAC name of [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine?
The IUPAC name of [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine (CID 116969377) is [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine.
What is the SMILES notation for [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine?
The canonical SMILES for [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine is NCC1(Cc2nc(-c3ccccc3F)cs2)CC1.
What is the InChIKey of [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine?
The InChIKey is WAVMTVRWENRPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2S/c15-11-4-2-1-3-10(11)12-8-18-13(17-12)7-14(9-16)5-6-14/h1-4,8H,5-7,9,16H2.
What are the key properties of [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine?
[1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine has a molecular weight of 262.35 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]cyclopropyl]methanamine is sourced from PubChem (CID 116969377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).