N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine

C15H17FN2S — CID 79439453

IUPACN-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine
SMILESFc1ccccc1C(CNC1CC1)Cc1cscn1
InChIInChI=1S/C15H17FN2S/c16-15-4-2-1-3-14(15)11(8-17-12-5-6-12)7-13-9-19-10-18-13/h1-4,9-12,17H,5-8H2
InChIKeyMBWHFNSEKPXWTH-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.36
Rot. Bonds6

About N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine

N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine (PubChem CID 79439453) has the molecular formula C15H17FN2S and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine
PubChem CID79439453
Molecular FormulaC15H17FN2S
Molecular Weight276.38 g/mol
Exact Mass276.11
IUPAC NameN-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine
SMILESFc1ccccc1C(CNC1CC1)Cc1cscn1
InChIInChI=1S/C15H17FN2S/c16-15-4-2-1-3-14(15)11(8-17-12-5-6-12)7-13-9-19-10-18-13/h1-4,9-12,17H,5-8H2
InChIKeyMBWHFNSEKPXWTH-UHFFFAOYSA-N
XLogP3.36
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine 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

4-[3-chloro-2-(2-fluorophenyl)propyl]-1,3-thiazole
CID 79454763
2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propan-1-amine
CID 79448591
N-[2-[(2-bromophenyl)methyl]-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine
CID 62514412
N-[2-(2-fluorophenyl)-6-methylheptyl]cyclopropanamine
CID 83169179
N-[2-(2-chlorophenyl)-3-(2-fluorophenyl)propyl]cyclopropanamine
CID 79436421
N-[2-(2-fluorophenyl)-4-[(2-methylpropan-2-yl)oxy]butyl]cyclopropanamine
CID 115943473
2-(2-methylphenyl)-N-propyl-3-(1,3-thiazol-4-yl)propan-1-amine
CID 79420864
N-[2-cyclohexyl-2-(2-fluorophenyl)ethyl]cyclopropanamine
CID 82934224
N-[2-(2-fluorophenyl)-4-(3-methoxypropoxy)butyl]cyclopropanamine
CID 103183708
N-[3-(4-bromothiophen-2-yl)-2-(2-chlorophenyl)propyl]cyclopropanamine
CID 79449507
1-(2-fluorophenyl)-N,N',2-trimethyl-N'-(1,3-thiazol-4-ylmethyl)propane-1,3-diamine
CID 115996809
N-[2-(2-fluorophenyl)-3-methylhexyl]cyclopropanamine
CID 107886995

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine?
The IUPAC name of N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine (CID 79439453) is N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine.
What is the SMILES notation for N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine?
The canonical SMILES for N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine is Fc1ccccc1C(CNC1CC1)Cc1cscn1.
What is the InChIKey of N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine?
The InChIKey is MBWHFNSEKPXWTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2S/c16-15-4-2-1-3-14(15)11(8-17-12-5-6-12)7-13-9-19-10-18-13/h1-4,9-12,17H,5-8H2.
What are the key properties of N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine?
N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine has a molecular weight of 276.38 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-3-(1,3-thiazol-4-yl)propyl]cyclopropanamine is sourced from PubChem (CID 79439453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).