2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane

C9H13ClN2O2 — CID 172576438

IUPAC2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane
SMILESCC.COc1nc(Cl)nc2c1COC2
InChIInChI=1S/C7H7ClN2O2.C2H6/c1-11-6-4-2-12-3-5(4)9-7(8)10-6;1-2/h2-3H2,1H3;1-2H3
InChIKeyDEEZKICSODAUCG-UHFFFAOYSA-N
MW216.67 g/mol
LogP2.19
Rot. Bonds1

About 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane

2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane (PubChem CID 172576438) has the molecular formula C9H13ClN2O2 and a molecular weight of 216.67 g/mol. Its IUPAC name is 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane.

Molecular Properties

Compound Name2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane
PubChem CID172576438
Molecular FormulaC9H13ClN2O2
Molecular Weight216.67 g/mol
Exact Mass216.07
IUPAC Name2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane
SMILESCC.COc1nc(Cl)nc2c1COC2
InChIInChI=1S/C7H7ClN2O2.C2H6/c1-11-6-4-2-12-3-5(4)9-7(8)10-6;1-2/h2-3H2,1H3;1-2H3
InChIKeyDEEZKICSODAUCG-UHFFFAOYSA-N
XLogP2.19
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.67
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane 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

2-chloro-4-methoxy-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
CID 105468148
N'-(4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)propane-1,3-diamine
CID 83839420
4-methoxy-2-piperidin-3-yl-5,7-dihydrofuro[3,4-d]pyrimidine
CID 105496379
(4Z)-6-chloro-4-ethylidene-8-methoxy-1H-pyrano[3,4-c]pyridine
CID 10585306
methyl 2-chloro-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine-4-carboxylate
CID 131545177
4-chloro-5,7-dihydrofuro[3,4-d]pyrimidin-2-amine
CID 83668205
2,4-dichloro-6-methoxy-5-methylpyrimidine
CID 118141128
2-(4-methoxy-6,8-dihydro-5H-pyrano[3,4-d]pyrimidin-2-yl)ethanamine
CID 105462878
3-(4-methoxy-6,8-dihydro-5H-pyrano[3,4-d]pyrimidin-2-yl)-N-methylpropan-1-amine
CID 105499150
2-N-(4-methoxy-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-2-yl)propane-1,2-diamine
CID 83842774
2,4-dimethyl-5,7-dihydrofuro[3,4-b]pyridine
CID 135256255
2,4-dimethoxy-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 156555750

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane?
The IUPAC name of 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane (CID 172576438) is 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane.
What is the SMILES notation for 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane?
The canonical SMILES for 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane is CC.COc1nc(Cl)nc2c1COC2.
What is the InChIKey of 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane?
The InChIKey is DEEZKICSODAUCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2O2.C2H6/c1-11-6-4-2-12-3-5(4)9-7(8)10-6;1-2/h2-3H2,1H3;1-2H3.
What are the key properties of 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane?
2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane has a molecular weight of 216.67 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methoxy-5,7-dihydrofuro[3,4-d]pyrimidine;ethane is sourced from PubChem (CID 172576438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).