N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide

C12H14N2OS2 — CID 17462106

IUPACN-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
SMILESCC(C)NC(=O)Cc1csc(-c2ccsc2)n1
InChIInChI=1S/C12H14N2OS2/c1-8(2)13-11(15)5-10-7-17-12(14-10)9-3-4-16-6-9/h3-4,6-8H,5H2,1-2H3,(H,13,15)
InChIKeyJFMDBKOBBZISOD-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.94
Rot. Bonds4

About N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide

N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 17462106) has the molecular formula C12H14N2OS2 and a molecular weight of 266.39 g/mol. Its IUPAC name is N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
PubChem CID17462106
Molecular FormulaC12H14N2OS2
Molecular Weight266.39 g/mol
Exact Mass266.05
IUPAC NameN-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
SMILESCC(C)NC(=O)Cc1csc(-c2ccsc2)n1
InChIInChI=1S/C12H14N2OS2/c1-8(2)13-11(15)5-10-7-17-12(14-10)9-3-4-16-6-9/h3-4,6-8H,5H2,1-2H3,(H,13,15)
InChIKeyJFMDBKOBBZISOD-UHFFFAOYSA-N
XLogP2.94
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-methyl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 28094182
3-[(2-Thiophen-3-yl-1,3-thiazol-4-yl)methylamino]azepan-2-one
CID 47614957
2-methyl-N-[2-[2-[1-(thiophene-3-carbonyl)piperidin-4-yl]-1,3-thiazol-4-yl]ethyl]propanamide
CID 53149509
2-methyl-N-(2-{2-[1-(3-thienylcarbonyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)propanamide
CID 71841753
N-[2-[2-[1-(thiophene-3-carbonyl)piperidin-3-yl]-1,3-thiazol-4-yl]ethyl]propanamide
CID 71841793
2-methyl-N-(2-sulfanylethyl)-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)propanamide
CID 177679737
2-(2-methyl-1,3-thiazol-4-yl)-N-[(3-methyl-2-thienyl)methyl]acetamide
CID 32958350
N-methyl-2-(2-propan-2-yl-1,3-thiazol-4-yl)-N-(thiophen-3-ylmethyl)acetamide
CID 45887477
1-[(2-Ethyl-1,3-thiazol-4-yl)methyl]-3-(thiophen-3-ylmethyl)urea
CID 72020838
(3S)-1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]pyrrolidine-3-carboxamide
CID 97189230
2-thiophen-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-4-carboxamide
CID 47120048
1-[4-(2,2-Difluoroethyl)piperazin-1-yl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanone
CID 49071081

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide (CID 17462106) is N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide is CC(C)NC(=O)Cc1csc(-c2ccsc2)n1.
What is the InChIKey of N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide?
The InChIKey is JFMDBKOBBZISOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS2/c1-8(2)13-11(15)5-10-7-17-12(14-10)9-3-4-16-6-9/h3-4,6-8H,5H2,1-2H3,(H,13,15).
What are the key properties of N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide?
N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 266.39 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 17462106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).