2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide

C16H18N2O2S — CID 45148025

IUPAC2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
SMILESCc1cnc(NC(=O)C(C)Oc2ccc3c(c2)CCC3)s1
InChIInChI=1S/C16H18N2O2S/c1-10-9-17-16(21-10)18-15(19)11(2)20-14-7-6-12-4-3-5-13(12)8-14/h6-9,11H,3-5H2,1-2H3,(H,17,18,19)
InChIKeyJVCBJPLODJATSW-UHFFFAOYSA-N
MW302.40 g/mol
LogP3.35
Rot. Bonds4

About 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide

2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide (PubChem CID 45148025) has the molecular formula C16H18N2O2S and a molecular weight of 302.40 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
PubChem CID45148025
Molecular FormulaC16H18N2O2S
Molecular Weight302.40 g/mol
Exact Mass302.11
IUPAC Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
SMILESCc1cnc(NC(=O)C(C)Oc2ccc3c(c2)CCC3)s1
InChIInChI=1S/C16H18N2O2S/c1-10-9-17-16(21-10)18-15(19)11(2)20-14-7-6-12-4-3-5-13(12)8-14/h6-9,11H,3-5H2,1-2H3,(H,17,18,19)
InChIKeyJVCBJPLODJATSW-UHFFFAOYSA-N
XLogP3.35
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(4-chlorophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 2678069
2-(4-bromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 17190941
N-(5-methyl-1,3-thiazol-2-yl)-2-phenoxypropanamide
CID 4812532
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-2-pyridinyl)propanamide
CID 45148000
N-(5-methyl-1,3-thiazol-2-yl)-2-(4-phenylphenoxy)propanamide
CID 46481508
(2R)-2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methylpyrimidin-2-yl)propanamide
CID 35328998
2-[2-(2,3-dihydro-1H-inden-5-yloxy)propanoylamino]-4,5-dimethylthiophene-3-carboxamide
CID 45153926
2-(2-methoxyphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 17190948
N-(5-methyl-1,3-thiazol-2-yl)-2-(2-propan-2-ylphenoxy)propanamide
CID 17190939
(2S)-N-cyclopentyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100702405
(2S)-N-(4-iodophenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100547354
N-(3-fluorophenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 133161949

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide (CID 45148025) is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide is Cc1cnc(NC(=O)C(C)Oc2ccc3c(c2)CCC3)s1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is JVCBJPLODJATSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2S/c1-10-9-17-16(21-10)18-15(19)11(2)20-14-7-6-12-4-3-5-13(12)8-14/h6-9,11H,3-5H2,1-2H3,(H,17,18,19).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 302.40 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 45148025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).