2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one

C10H14N2O2 — CID 137272882

IUPAC2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one
SMILESCCc1nc2c(c(=O)[nH]1)C(C)(C)OC2
InChIInChI=1S/C10H14N2O2/c1-4-7-11-6-5-14-10(2,3)8(6)9(13)12-7/h4-5H2,1-3H3,(H,11,12,13)
InChIKeyKLRPJLOVDWWKSM-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.10
Rot. Bonds1

About 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one

2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one (PubChem CID 137272882) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one.

Molecular Properties

Compound Name2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one
PubChem CID137272882
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one
SMILESCCc1nc2c(c(=O)[nH]1)C(C)(C)OC2
InChIInChI=1S/C10H14N2O2/c1-4-7-11-6-5-14-10(2,3)8(6)9(13)12-7/h4-5H2,1-3H3,(H,11,12,13)
InChIKeyKLRPJLOVDWWKSM-UHFFFAOYSA-N
XLogP1.10
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5,7-Dihydro-2-methylfuro[3,4-d]pyrimidin-4-ol
CID 135819035
2,5,7-trimethyl-5,7-dihydro-3H-furo[3,4-d]pyrimidin-4-one
CID 136442752
2,7-dimethyl-5,7-dihydro-3H-furo[3,4-d]pyrimidin-4-one
CID 136442772
3-(4-Oxo-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-yl)propanamide
CID 136627273
2-Butan-2-yl-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-4-one
CID 136696218
2-Ethyl-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-4-one
CID 136696292
2-tert-butyl-5,7-dihydro-3H-furo[3,4-d]pyrimidin-4-one
CID 137049007
2-propan-2-yl-5,7-dihydro-3H-furo[3,4-d]pyrimidin-4-one
CID 137128195
2,7,7-trimethyl-3H-furo[3,4-d]pyrimidine-4,5-dione
CID 141461929
7,7-dimethyl-2-propyl-3H-furo[3,4-d]pyrimidine-4,5-dione
CID 141461940
2-cyclopropyl-7,7-dimethyl-3H-furo[3,4-d]pyrimidine-4,5-dione
CID 141461950
2-Chloro-7,7-dimethyl-3,5-dihydrofuro[3,4-d]pyrimidin-4-one
CID 172576423

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one?
The IUPAC name of 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one (CID 137272882) is 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one.
What is the SMILES notation for 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one?
The canonical SMILES for 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one is CCc1nc2c(c(=O)[nH]1)C(C)(C)OC2.
What is the InChIKey of 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one?
The InChIKey is KLRPJLOVDWWKSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-4-7-11-6-5-14-10(2,3)8(6)9(13)12-7/h4-5H2,1-3H3,(H,11,12,13).
What are the key properties of 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one?
2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one has a molecular weight of 194.23 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5,5-dimethyl-3,7-dihydrofuro[3,4-d]pyrimidin-4-one is sourced from PubChem (CID 137272882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).