1-(dipropoxymethyl)-2-methylcyclopropane

C11H22O2 — CID 59066798

IUPAC1-(dipropoxymethyl)-2-methylcyclopropane
SMILESCCCOC(OCCC)C1CC1C
InChIInChI=1S/C11H22O2/c1-4-6-12-11(13-7-5-2)10-8-9(10)3/h9-11H,4-8H2,1-3H3
InChIKeyCUIKLQABPHPIIN-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.82
Rot. Bonds7

About 1-(dipropoxymethyl)-2-methylcyclopropane

1-(dipropoxymethyl)-2-methylcyclopropane (PubChem CID 59066798) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 1-(dipropoxymethyl)-2-methylcyclopropane.

Molecular Properties

Compound Name1-(dipropoxymethyl)-2-methylcyclopropane
PubChem CID59066798
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name1-(dipropoxymethyl)-2-methylcyclopropane
SMILESCCCOC(OCCC)C1CC1C
InChIInChI=1S/C11H22O2/c1-4-6-12-11(13-7-5-2)10-8-9(10)3/h9-11H,4-8H2,1-3H3
InChIKeyCUIKLQABPHPIIN-UHFFFAOYSA-N
XLogP2.82
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(3S,4S)-3-(diethoxymethyl)-4,7,7-trimethylbicyclo[4.1.0]heptane
CID 102104759
2-(dipropoxymethyl)oxolane
CID 12664780
(2R,3R)-2,3-dipropoxybutane
CID 118445331
1,2-dimethyl-3-pentan-2-ylcyclobutane
CID 123945019
1-heptan-2-yl-2-methylcyclopropane
CID 91084036
1-propoxyethylcyclopentane
CID 159612357
cis-(2S,6R)-2,6-dimethyl-4-propoxycyclohexan-1-ol
CID 92538664
1-methyl-2-(3-methylnonan-4-yl)cyclopropane
CID 91046160
[(2-methylcyclopropyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105235034
1,2-dimethylcyclopropane;propane
CID 143337919
1-(3-ethylpentan-2-yl)-2-methylcyclopropane
CID 91445578
trans-propyl (1R,2R)-2-methylcyclopropane-1-carboxylate
CID 93032108

Frequently Asked Questions

What is the IUPAC name of 1-(dipropoxymethyl)-2-methylcyclopropane?
The IUPAC name of 1-(dipropoxymethyl)-2-methylcyclopropane (CID 59066798) is 1-(dipropoxymethyl)-2-methylcyclopropane.
What is the SMILES notation for 1-(dipropoxymethyl)-2-methylcyclopropane?
The canonical SMILES for 1-(dipropoxymethyl)-2-methylcyclopropane is CCCOC(OCCC)C1CC1C.
What is the InChIKey of 1-(dipropoxymethyl)-2-methylcyclopropane?
The InChIKey is CUIKLQABPHPIIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-4-6-12-11(13-7-5-2)10-8-9(10)3/h9-11H,4-8H2,1-3H3.
What are the key properties of 1-(dipropoxymethyl)-2-methylcyclopropane?
1-(dipropoxymethyl)-2-methylcyclopropane has a molecular weight of 186.29 g/mol, XLogP of 2.82, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dipropoxymethyl)-2-methylcyclopropane is sourced from PubChem (CID 59066798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).