1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane

C12H24O — CID 20662322

IUPAC1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane
SMILESCOCC1CC(C(C)C)C(C)C1C
InChIInChI=1S/C12H24O/c1-8(2)12-6-11(7-13-5)9(3)10(12)4/h8-12H,6-7H2,1-5H3
InChIKeyZYUBWGXEPADBMC-UHFFFAOYSA-N
MW184.32 g/mol
LogP3.20
Rot. Bonds3

About 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane

1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane (PubChem CID 20662322) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane.

Molecular Properties

Compound Name1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane
PubChem CID20662322
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane
SMILESCOCC1CC(C(C)C)C(C)C1C
InChIInChI=1S/C12H24O/c1-8(2)12-6-11(7-13-5)9(3)10(12)4/h8-12H,6-7H2,1-5H3
InChIKeyZYUBWGXEPADBMC-UHFFFAOYSA-N
XLogP3.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Iridoid skeleton
CID 45098403
2-(Methoxymethyl)bicyclo[2.2.1]heptane
CID 13807638
2-Methyl-5-(1-methylethyl)cyclopentanemethanol
CID 147021
4-Ethyl-1-hexyl-2-(2,2,2-trifluoroethoxymethyl)cyclopentane
CID 58813219
1-(Difluoromethoxymethyl)-3-propan-2-ylcyclopentane
CID 169181725
(3R)-1-(difluoromethoxymethyl)-3-propan-2-ylcyclopentane
CID 169182125
1-(2-Fluorobutyl)-1-(methoxymethyl)-2-methylcyclopentane
CID 172247135
6-(2-Fluorobutyl)-6-(methoxymethyl)-5-methylspiro[2.4]heptane
CID 172247294
Cyclopentaneethanol, beta,2,3-trimethyl-
CID 549899
4,7-Dimethyloctahydrocyclopenta[c]pyran
CID 93508430
(3S)-3-(methoxymethyl)-1,1,2,2-tetramethylcyclopentane
CID 135037331
Cyclopentane, 2-(1-hydroxy-2-propyl)-1,3-dimethyl-
CID 565924

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane?
The IUPAC name of 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane (CID 20662322) is 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane.
What is the SMILES notation for 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane?
The canonical SMILES for 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane is COCC1CC(C(C)C)C(C)C1C.
What is the InChIKey of 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane?
The InChIKey is ZYUBWGXEPADBMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O/c1-8(2)12-6-11(7-13-5)9(3)10(12)4/h8-12H,6-7H2,1-5H3.
What are the key properties of 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane?
1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane has a molecular weight of 184.32 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-2,3-dimethyl-4-propan-2-ylcyclopentane is sourced from PubChem (CID 20662322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).