3,5-dimethylcyclopenta-2,5-diene-1,2-diol

C7H10O2 — CID 58446340

IUPAC3,5-dimethylcyclopenta-2,5-diene-1,2-diol
SMILESCC1=C(O)C(O)=C(C)C1
InChIInChI=1S/C7H10O2/c1-4-3-5(2)7(9)6(4)8/h8-9H,3H2,1-2H3
InChIKeyVPTMFJALGHYXHM-UHFFFAOYSA-N
MW126.15 g/mol
LogP2.05
Rot. Bonds

About 3,5-dimethylcyclopenta-2,5-diene-1,2-diol

3,5-dimethylcyclopenta-2,5-diene-1,2-diol (PubChem CID 58446340) has the molecular formula C7H10O2 and a molecular weight of 126.15 g/mol. Its IUPAC name is 3,5-dimethylcyclopenta-2,5-diene-1,2-diol.

Molecular Properties

Compound Name3,5-dimethylcyclopenta-2,5-diene-1,2-diol
PubChem CID58446340
Molecular FormulaC7H10O2
Molecular Weight126.15 g/mol
Exact Mass126.07
IUPAC Name3,5-dimethylcyclopenta-2,5-diene-1,2-diol
SMILESCC1=C(O)C(O)=C(C)C1
InChIInChI=1S/C7H10O2/c1-4-3-5(2)7(9)6(4)8/h8-9H,3H2,1-2H3
InChIKeyVPTMFJALGHYXHM-UHFFFAOYSA-N
XLogP2.05
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.15
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3,5-dimethylcyclopenta-2,5-diene-1,2-diol 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-hydroxy-3-methylcyclobut-2-en-1-one
CID 58489247
1,4,5-trimethyl-3H-pyrrol-1-ium-2-ol
CID 20667801
ethane;3-hydroxy-4-methylcyclopent-3-en-1-one
CID 144684299
1,2,3,5,6-pentamethyl-4H-borinine
CID 174332555
1,2,3,4-tetramethylcyclopenta-1,3-diene;trifluorotitanium
CID 172805341
4-ethyl-5-hydroxycyclopent-4-ene-1,3-dione
CID 12729186
2,6-dimethylcyclohexa-1,5-dien-1-ol
CID 14982407
(1S)-3-ethyl-4-methylcyclopent-3-en-1-ol
CID 67576321
(5-methyl-4H-pyrazol-3-yl)methanol
CID 90231746
2,3,7,8-tetramethyl-5-silaspiro[4.4]nona-2,7-diene
CID 13049558
bis(4-butyl-1,2-dimethylcyclopenta-1,3-diene);hafnium(4+);dichloride
CID 87376290
2-methyl-4-methylidenecyclohexa-1,5-dien-1-ol
CID 154540203

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethylcyclopenta-2,5-diene-1,2-diol?
The IUPAC name of 3,5-dimethylcyclopenta-2,5-diene-1,2-diol (CID 58446340) is 3,5-dimethylcyclopenta-2,5-diene-1,2-diol.
What is the SMILES notation for 3,5-dimethylcyclopenta-2,5-diene-1,2-diol?
The canonical SMILES for 3,5-dimethylcyclopenta-2,5-diene-1,2-diol is CC1=C(O)C(O)=C(C)C1.
What is the InChIKey of 3,5-dimethylcyclopenta-2,5-diene-1,2-diol?
The InChIKey is VPTMFJALGHYXHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O2/c1-4-3-5(2)7(9)6(4)8/h8-9H,3H2,1-2H3.
What are the key properties of 3,5-dimethylcyclopenta-2,5-diene-1,2-diol?
3,5-dimethylcyclopenta-2,5-diene-1,2-diol has a molecular weight of 126.15 g/mol, XLogP of 2.05, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethylcyclopenta-2,5-diene-1,2-diol is sourced from PubChem (CID 58446340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).