cyclopropylmethyl methyl carbonate

C6H10O3 — CID 54535586

IUPACcyclopropylmethyl methyl carbonate
SMILESCOC(=O)OCC1CC1
InChIInChI=1S/C6H10O3/c1-8-6(7)9-4-5-2-3-5/h5H,2-4H2,1H3
InChIKeyJMGCQERJQCMLSS-UHFFFAOYSA-N
MW130.14 g/mol
LogP1.18
Rot. Bonds2

About cyclopropylmethyl methyl carbonate

cyclopropylmethyl methyl carbonate (PubChem CID 54535586) has the molecular formula C6H10O3 and a molecular weight of 130.14 g/mol. Its IUPAC name is cyclopropylmethyl methyl carbonate.

Molecular Properties

Compound Namecyclopropylmethyl methyl carbonate
PubChem CID54535586
Molecular FormulaC6H10O3
Molecular Weight130.14 g/mol
Exact Mass130.06
IUPAC Namecyclopropylmethyl methyl carbonate
SMILESCOC(=O)OCC1CC1
InChIInChI=1S/C6H10O3/c1-8-6(7)9-4-5-2-3-5/h5H,2-4H2,1H3
InChIKeyJMGCQERJQCMLSS-UHFFFAOYSA-N
XLogP1.18
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.14
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze cyclopropylmethyl methyl carbonate 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

4-O-[[4-(methoxycarbonyloxymethyl)cyclohexyl]methyl] 1-O-propyl but-2-enedioate
CID 118908468
methyl pyrrolidin-3-ylmethyl carbonate
CID 79337934
cyclopropylmethyl acetate
CID 538333
(4-methylcyclohexyl)methyl 2-methylpropyl carbonate
CID 68661013
cyclopropylmethyl 3-oxobutanoate
CID 10012135
cyclopropylmethyl 2-sulfanylpropanoate
CID 107018198
cyclopropylmethyl 2-methoxy-3-methylbutanoate
CID 156662867
1-O-(cyclopentylmethyl) 3-O-methyl 2-methylpropanedioate
CID 174748990
2-cyclopentylethyl methyl carbonate
CID 66771150
methyl 2-acetamido-3-(cyclopropylmethoxy)propanoate
CID 65443972
4-O-[[4-[[3-(tert-butylamino)-4-methoxy-4-oxobutanoyl]oxymethyl]cyclohexyl]methyl] 1-O-methyl 2-(tert-butylamino)butanedioate
CID 58785269
cyclopropylmethyl carbonochloridate
CID 15917591

Frequently Asked Questions

What is the IUPAC name of cyclopropylmethyl methyl carbonate?
The IUPAC name of cyclopropylmethyl methyl carbonate (CID 54535586) is cyclopropylmethyl methyl carbonate.
What is the SMILES notation for cyclopropylmethyl methyl carbonate?
The canonical SMILES for cyclopropylmethyl methyl carbonate is COC(=O)OCC1CC1.
What is the InChIKey of cyclopropylmethyl methyl carbonate?
The InChIKey is JMGCQERJQCMLSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O3/c1-8-6(7)9-4-5-2-3-5/h5H,2-4H2,1H3.
What are the key properties of cyclopropylmethyl methyl carbonate?
cyclopropylmethyl methyl carbonate has a molecular weight of 130.14 g/mol, XLogP of 1.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylmethyl methyl carbonate is sourced from PubChem (CID 54535586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).