N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide

C11H12N2O2S — CID 110470912

IUPACN-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide
SMILESCC(C)(NC(=O)c1ccco1)c1nccs1
InChIInChI=1S/C11H12N2O2S/c1-11(2,10-12-5-7-16-10)13-9(14)8-4-3-6-15-8/h3-7H,1-2H3,(H,13,14)
InChIKeyVPRWIZZIJZWGDX-UHFFFAOYSA-N
MW236.30 g/mol
LogP2.40
Rot. Bonds3

About N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide

N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide (PubChem CID 110470912) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide
PubChem CID110470912
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC NameN-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide
SMILESCC(C)(NC(=O)c1ccco1)c1nccs1
InChIInChI=1S/C11H12N2O2S/c1-11(2,10-12-5-7-16-10)13-9(14)8-4-3-6-15-8/h3-7H,1-2H3,(H,13,14)
InChIKeyVPRWIZZIJZWGDX-UHFFFAOYSA-N
XLogP2.40
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-3-carboxamide
CID 107091806
2-phenyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]acetamide
CID 110472120
6-[2-(1,3-thiazol-2-yl)propan-2-ylcarbamoyl]pyridine-2-carboxylic acid
CID 103790286
4-hydroxy-2-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]benzamide
CID 103865536
2,5-dibromo-N-[2-(1,3-thiazol-2-yl)propan-2-yl]benzamide
CID 104919793
3-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyridine-4-carboxamide
CID 114131562
N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide
CID 110443410
N-[2,2,2-trichloro-1-(1,3-thiazol-2-ylamino)ethyl]furan-2-carboxamide
CID 3509432
4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide
CID 114130919
4-(pyridin-4-ylsulfamoyl)-N-[2-(1,3-thiazol-2-yl)propan-2-yl]benzamide
CID 86962252
5-chloro-4-hydroxy-2-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]benzamide
CID 146149973
4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxane-4-carboxamide
CID 103845803

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide (CID 110470912) is N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide is CC(C)(NC(=O)c1ccco1)c1nccs1.
What is the InChIKey of N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide?
The InChIKey is VPRWIZZIJZWGDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c1-11(2,10-12-5-7-16-10)13-9(14)8-4-3-6-15-8/h3-7H,1-2H3,(H,13,14).
What are the key properties of N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide?
N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide has a molecular weight of 236.30 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 110470912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).