N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide

C20H17FN2OS — CID 42570316

IUPACN-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide
SMILESO=C(Cc1cnc(-c2ccccc2F)s1)NC1Cc2ccccc2C1
InChIInChI=1S/C20H17FN2OS/c21-18-8-4-3-7-17(18)20-22-12-16(25-20)11-19(24)23-15-9-13-5-1-2-6-14(13)10-15/h1-8,12,15H,9-11H2,(H,23,24)
InChIKeyMQSCWRQEBGDXMF-UHFFFAOYSA-N
MW352.43 g/mol
LogP3.78
Rot. Bonds4

About N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide

N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide (PubChem CID 42570316) has the molecular formula C20H17FN2OS and a molecular weight of 352.43 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide
PubChem CID42570316
Molecular FormulaC20H17FN2OS
Molecular Weight352.43 g/mol
Exact Mass352.10
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide
SMILESO=C(Cc1cnc(-c2ccccc2F)s1)NC1Cc2ccccc2C1
InChIInChI=1S/C20H17FN2OS/c21-18-8-4-3-7-17(18)20-22-12-16(25-20)11-19(24)23-15-9-13-5-1-2-6-14(13)10-15/h1-8,12,15H,9-11H2,(H,23,24)
InChIKeyMQSCWRQEBGDXMF-UHFFFAOYSA-N
XLogP3.78
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide (CID 42570316) is N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide is O=C(Cc1cnc(-c2ccccc2F)s1)NC1Cc2ccccc2C1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide?
The InChIKey is MQSCWRQEBGDXMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2OS/c21-18-8-4-3-7-17(18)20-22-12-16(25-20)11-19(24)23-15-9-13-5-1-2-6-14(13)10-15/h1-8,12,15H,9-11H2,(H,23,24).
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide?
N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide has a molecular weight of 352.43 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide is sourced from PubChem (CID 42570316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).