1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine

C11H15N3OS — CID 66390753

IUPAC1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine
SMILESCC(N)c1nc(CNCc2ccco2)cs1
InChIInChI=1S/C11H15N3OS/c1-8(12)11-14-9(7-16-11)5-13-6-10-3-2-4-15-10/h2-4,7-8,13H,5-6,12H2,1H3
InChIKeyMOADPHGWFJIXJD-UHFFFAOYSA-N
MW237.33 g/mol
LogP2.05
Rot. Bonds5

About 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine

1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine (PubChem CID 66390753) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine.

Molecular Properties

Compound Name1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine
PubChem CID66390753
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC Name1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine
SMILESCC(N)c1nc(CNCc2ccco2)cs1
InChIInChI=1S/C11H15N3OS/c1-8(12)11-14-9(7-16-11)5-13-6-10-3-2-4-15-10/h2-4,7-8,13H,5-6,12H2,1H3
InChIKeyMOADPHGWFJIXJD-UHFFFAOYSA-N
XLogP2.05
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine 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-[4-[(benzylamino)methyl]-1,3-thiazol-2-yl]ethanamine
CID 66388061
N-[[2-(1-aminoethyl)-1,3-thiazol-4-yl]methyl]-N-(furan-2-ylmethyl)cyclopropanamine
CID 66390382
N-[[2-(aminomethyl)-1,3-thiazol-4-yl]methyl]-1-(furan-2-yl)propan-2-amine
CID 66379865
N-[[2-(1-aminoethyl)-1,3-thiazol-4-yl]methyl]-2,2,3,3-tetrafluoropropan-1-amine
CID 106293897
(3S)-1-N-(furan-2-ylmethyl)butane-1,3-diamine
CID 66594455
2-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]-N-(2-methoxyphenyl)acetamide
CID 2455372
1-[2-(furan-2-yl)ethyl]-2-methyl-3-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]guanidine
CID 111354218
4-(furan-2-ylmethylsulfamoyl)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]benzamide
CID 56558217
N-(furan-2-ylmethyl)-2-methylbutan-1-amine
CID 43200420
N-(furan-2-ylmethyl)-2-[(2-methyl-1,3-thiazol-4-yl)methylamino]propanamide
CID 61285392
1-N-(furan-2-ylmethyl)-4-methylpentane-1,2-diamine
CID 61150201
1-(furan-2-yl)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)methanamine
CID 78977028

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine?
The IUPAC name of 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine (CID 66390753) is 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine.
What is the SMILES notation for 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine?
The canonical SMILES for 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine is CC(N)c1nc(CNCc2ccco2)cs1.
What is the InChIKey of 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine?
The InChIKey is MOADPHGWFJIXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c1-8(12)11-14-9(7-16-11)5-13-6-10-3-2-4-15-10/h2-4,7-8,13H,5-6,12H2,1H3.
What are the key properties of 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine?
1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine has a molecular weight of 237.33 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(furan-2-ylmethylamino)methyl]-1,3-thiazol-2-yl]ethanamine is sourced from PubChem (CID 66390753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).