1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine

C13H18N2OS — CID 43783208

IUPAC1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine
SMILESCc1ncsc1C(C)NC(C)Cc1ccco1
InChIInChI=1S/C13H18N2OS/c1-9(7-12-5-4-6-16-12)15-11(3)13-10(2)14-8-17-13/h4-6,8-9,11,15H,7H2,1-3H3
InChIKeyGTZNAXGBKMEKBV-UHFFFAOYSA-N
MW250.37 g/mol
LogP3.33
Rot. Bonds5

About 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine

1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine (PubChem CID 43783208) has the molecular formula C13H18N2OS and a molecular weight of 250.37 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine
PubChem CID43783208
Molecular FormulaC13H18N2OS
Molecular Weight250.37 g/mol
Exact Mass250.11
IUPAC Name1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine
SMILESCc1ncsc1C(C)NC(C)Cc1ccco1
InChIInChI=1S/C13H18N2OS/c1-9(7-12-5-4-6-16-12)15-11(3)13-10(2)14-8-17-13/h4-6,8-9,11,15H,7H2,1-3H3
InChIKeyGTZNAXGBKMEKBV-UHFFFAOYSA-N
XLogP3.33
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.37
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine 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

1-(furan-2-yl)-N-[1-(furan-2-yl)propan-2-yl]propan-2-amine
CID 55179966
N-[(1S)-1-(4-chlorophenyl)ethyl]-1-(furan-2-yl)propan-2-amine
CID 81352005
N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]hept-6-en-2-amine
CID 115906867
1-(furan-2-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propan-2-amine
CID 106209160
1-N,1-N-diethyl-2-N-[1-(furan-2-yl)propan-2-yl]propane-1,2-diamine
CID 55179779
N-[1-(2,3-difluorophenyl)ethyl]-1-(furan-2-yl)propan-2-amine
CID 103924689
furan-2-yl-(4-methyl-1,3-thiazol-5-yl)methanol
CID 22101827
1-(4-ethoxyphenyl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]ethanamine
CID 43788971
1-(furan-2-yl)-N-[1-[4-(trifluoromethyl)phenyl]ethyl]propan-2-amine
CID 43692929
(1S)-1-(3-fluorophenyl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]ethanamine
CID 81365857
(1S)-1-(3-chlorophenyl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]ethanamine
CID 81366710
N-[1-(2,5-difluorophenyl)ethyl]-1-(furan-2-yl)propan-2-amine
CID 43693054

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine?
The IUPAC name of 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine (CID 43783208) is 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine.
What is the SMILES notation for 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine?
The canonical SMILES for 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine is Cc1ncsc1C(C)NC(C)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine?
The InChIKey is GTZNAXGBKMEKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2OS/c1-9(7-12-5-4-6-16-12)15-11(3)13-10(2)14-8-17-13/h4-6,8-9,11,15H,7H2,1-3H3.
What are the key properties of 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine?
1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine has a molecular weight of 250.37 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]propan-2-amine is sourced from PubChem (CID 43783208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).