4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine

C11H15N3OS — CID 105499490

IUPAC4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine
SMILESCOc1nc(C2CCNC2)nc2c1CSC2
InChIInChI=1S/C11H15N3OS/c1-15-11-8-5-16-6-9(8)13-10(14-11)7-2-3-12-4-7/h7,12H,2-6H2,1H3
InChIKeyFPSVUEFORCRNQL-UHFFFAOYSA-N
MW237.33 g/mol
LogP1.31
Rot. Bonds2

About 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine

4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine (PubChem CID 105499490) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine.

Molecular Properties

Compound Name4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine
PubChem CID105499490
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC Name4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine
SMILESCOc1nc(C2CCNC2)nc2c1CSC2
InChIInChI=1S/C11H15N3OS/c1-15-11-8-5-16-6-9(8)13-10(14-11)7-2-3-12-4-7/h7,12H,2-6H2,1H3
InChIKeyFPSVUEFORCRNQL-UHFFFAOYSA-N
XLogP1.31
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-2-pyrrolidin-3-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 115040229
4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 105493352
2-piperidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 105498181
4-methoxy-2-piperidin-3-yl-5,7-dihydrofuro[3,4-d]pyrimidine
CID 105496379
4-methoxy-2-piperidin-4-yl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 115040233
4-methoxy-5,7-dihydrothieno[3,4-d]pyrimidine-2-carbaldehyde
CID 105449901
5-methoxy-3-pyrrolidin-3-yl-1,2,4-oxadiazole
CID 82652996
2-(4-methoxy-5,7-dihydrothieno[3,4-d]pyrimidin-2-yl)ethanol
CID 105466025
2,3-dimethoxy-4-pyrrolidin-3-ylpyridine
CID 84676139
methyl 4-[[4,6-di(pyrrolidin-3-yl)-1,3,5-triazin-2-yl]amino]benzoate
CID 171851129
4-chloro-2-cyclohexyl-5,7-dihydrothieno[3,4-d]pyrimidine
CID 83190798
3-pyrrolidin-3-yl-1,2,4-thiadiazol-5-amine
CID 82412367

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine?
The IUPAC name of 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine (CID 105499490) is 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine.
What is the SMILES notation for 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine?
The canonical SMILES for 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine is COc1nc(C2CCNC2)nc2c1CSC2.
What is the InChIKey of 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine?
The InChIKey is FPSVUEFORCRNQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c1-15-11-8-5-16-6-9(8)13-10(14-11)7-2-3-12-4-7/h7,12H,2-6H2,1H3.
What are the key properties of 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine?
4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine has a molecular weight of 237.33 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-pyrrolidin-3-yl-5,7-dihydrothieno[3,4-d]pyrimidine is sourced from PubChem (CID 105499490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).