2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine

C10H15N3 — CID 59487096

IUPAC2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine
SMILESCc1ncc2c(n1)CN(C(C)C)C2
InChIInChI=1S/C10H15N3/c1-7(2)13-5-9-4-11-8(3)12-10(9)6-13/h4,7H,5-6H2,1-3H3
InChIKeyMNOWXFCYXRGHIW-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.51
Rot. Bonds1

About 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine

2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine (PubChem CID 59487096) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine.

Molecular Properties

Compound Name2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine
PubChem CID59487096
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine
SMILESCc1ncc2c(n1)CN(C(C)C)C2
InChIInChI=1S/C10H15N3/c1-7(2)13-5-9-4-11-8(3)12-10(9)6-13/h4,7H,5-6H2,1-3H3
InChIKeyMNOWXFCYXRGHIW-UHFFFAOYSA-N
XLogP1.51
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine?
The IUPAC name of 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine (CID 59487096) is 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine.
What is the SMILES notation for 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine?
The canonical SMILES for 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine is Cc1ncc2c(n1)CN(C(C)C)C2.
What is the InChIKey of 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine?
The InChIKey is MNOWXFCYXRGHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-7(2)13-5-9-4-11-8(3)12-10(9)6-13/h4,7H,5-6H2,1-3H3.
What are the key properties of 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine?
2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine has a molecular weight of 177.25 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidine is sourced from PubChem (CID 59487096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).