[2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone

C16H14N2O2S — CID 44581430

IUPAC[2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone
SMILESCN(C)c1nc(-c2ccco2)c(C(=O)c2ccccc2)s1
InChIInChI=1S/C16H14N2O2S/c1-18(2)16-17-13(12-9-6-10-20-12)15(21-16)14(19)11-7-4-3-5-8-11/h3-10H,1-2H3
InChIKeyZFPWYHVOECDVBQ-UHFFFAOYSA-N
MW298.37 g/mol
LogP3.70
Rot. Bonds4

About [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone

[2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone (PubChem CID 44581430) has the molecular formula C16H14N2O2S and a molecular weight of 298.37 g/mol. Its IUPAC name is [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone.

Molecular Properties

Compound Name[2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone
PubChem CID44581430
Molecular FormulaC16H14N2O2S
Molecular Weight298.37 g/mol
Exact Mass298.08
IUPAC Name[2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone
SMILESCN(C)c1nc(-c2ccco2)c(C(=O)c2ccccc2)s1
InChIInChI=1S/C16H14N2O2S/c1-18(2)16-17-13(12-9-6-10-20-12)15(21-16)14(19)11-7-4-3-5-8-11/h3-10H,1-2H3
InChIKeyZFPWYHVOECDVBQ-UHFFFAOYSA-N
XLogP3.70
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone 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

Mb-07803
CID 24770445
Sipagladenant
CID 23144148
A1/A3 AR antagonist 2
CID 162673862
Bis(furan-2-yl)-1,3-thiazol-2-amine
CID 2428993
2-[2-[3-(Furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-phenyl-1,3-thiazol-5-yl]acetic acid
CID 4884442
(4-(Furan-2-yl)-2-(thiophen-2-ylmethylamino)thiazol-5-yl)(phenyl)methanone
CID 15950360
(2-(3,4-Difluorobenzylamino)-4-(furan-2-yl)thiazol-5-yl)(phenyl)methanone
CID 16050635
{5-[2-Amino-5-(2,2-dimethylpropionyl)thiazol-4-yl]-furan-2-yl}phosphonic acid
CID 24770594
(2-(Benzyl(furan-2-ylmethyl)amino)-4-(furan-2-yl)thiazol-5-yl)(phenyl)methanone
CID 25211166
(4-(Furan-2-yl)-2-(furan-2-ylmethylamino)thiazol-5-yl)(phenyl)methanone
CID 25211167
(4-(Furan-2-yl)-2-(methylamino)thiazol-5-yl)(phenyl)methanone
CID 44581364
(4-(Furan-2-yl)-2-(isobutylamino)thiazol-5-yl)(phenyl)methanone
CID 44581365

Frequently Asked Questions

What is the IUPAC name of [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone?
The IUPAC name of [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone (CID 44581430) is [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone.
What is the SMILES notation for [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone?
The canonical SMILES for [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone is CN(C)c1nc(-c2ccco2)c(C(=O)c2ccccc2)s1.
What is the InChIKey of [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone?
The InChIKey is ZFPWYHVOECDVBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2S/c1-18(2)16-17-13(12-9-6-10-20-12)15(21-16)14(19)11-7-4-3-5-8-11/h3-10H,1-2H3.
What are the key properties of [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone?
[2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone has a molecular weight of 298.37 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(dimethylamino)-4-(furan-2-yl)-1,3-thiazol-5-yl]-phenylmethanone is sourced from PubChem (CID 44581430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).