4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine

C16H14N2OS — CID 133407372

IUPAC4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine
SMILESCc1cc2c(Oc3ccc4c(c3)CCC4)ncnc2s1
InChIInChI=1S/C16H14N2OS/c1-10-7-14-15(17-9-18-16(14)20-10)19-13-6-5-11-3-2-4-12(11)8-13/h5-9H,2-4H2,1H3
InChIKeyLUTPMXGVUSWQSO-UHFFFAOYSA-N
MW282.37 g/mol
LogP4.28
Rot. Bonds2

About 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine

4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine (PubChem CID 133407372) has the molecular formula C16H14N2OS and a molecular weight of 282.37 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine
PubChem CID133407372
Molecular FormulaC16H14N2OS
Molecular Weight282.37 g/mol
Exact Mass282.08
IUPAC Name4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine
SMILESCc1cc2c(Oc3ccc4c(c3)CCC4)ncnc2s1
InChIInChI=1S/C16H14N2OS/c1-10-7-14-15(17-9-18-16(14)20-10)19-13-6-5-11-3-2-4-12(11)8-13/h5-9H,2-4H2,1H3
InChIKeyLUTPMXGVUSWQSO-UHFFFAOYSA-N
XLogP4.28
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,5-dimethoxyphenoxy)-6-methylthieno[2,3-d]pyrimidine
CID 133407602
4-(6-methylthieno[2,3-d]pyrimidin-4-yl)oxybenzoic acid
CID 63616892
6-methyl-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine
CID 20963306
2,5-dichloro-4-(2,3-dihydro-1H-inden-5-yloxy)pyrimidine
CID 79633379
4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine
CID 79916312
5-bromo-6-(2,3-dihydro-1H-inden-5-yloxy)-4-methylpyridin-3-amine
CID 104507282
4-(6-methylthieno[2,3-d]pyrimidin-4-yl)oxythiophene-2-carboxylic acid
CID 66436488
5-chloro-4-(2,3-dihydro-1H-inden-5-yloxy)-N-methylpyrimidin-2-amine
CID 80881424
6-methyl-4-(1-oxidopyridin-1-ium-2-yl)oxythieno[2,3-d]pyrimidine
CID 133407550
2-(2,3-dihydro-1H-inden-5-yloxy)-6-methylpyridin-3-amine
CID 81133195
4-chloro-5-(chloromethyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidine
CID 107088182
6-methyl-4-(5-methyl-2-nitrophenoxy)thieno[2,3-d]pyrimidine
CID 133407813

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine?
The IUPAC name of 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine (CID 133407372) is 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine.
What is the SMILES notation for 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine?
The canonical SMILES for 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine is Cc1cc2c(Oc3ccc4c(c3)CCC4)ncnc2s1.
What is the InChIKey of 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine?
The InChIKey is LUTPMXGVUSWQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2OS/c1-10-7-14-15(17-9-18-16(14)20-10)19-13-6-5-11-3-2-4-12(11)8-13/h5-9H,2-4H2,1H3.
What are the key properties of 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine?
4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine has a molecular weight of 282.37 g/mol, XLogP of 4.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-inden-5-yloxy)-6-methylthieno[2,3-d]pyrimidine is sourced from PubChem (CID 133407372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).