1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane

C10H19ClO — CID 130587203

IUPAC1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane
SMILESCOC1CCCC1C(C)(C)CCl
InChIInChI=1S/C10H19ClO/c1-10(2,7-11)8-5-4-6-9(8)12-3/h8-9H,4-7H2,1-3H3
InChIKeyWGVOLRLXTGAJDT-UHFFFAOYSA-N
MW190.71 g/mol
LogP3.07
Rot. Bonds3

About 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane

1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane (PubChem CID 130587203) has the molecular formula C10H19ClO and a molecular weight of 190.71 g/mol. Its IUPAC name is 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane.

Molecular Properties

Compound Name1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane
PubChem CID130587203
Molecular FormulaC10H19ClO
Molecular Weight190.71 g/mol
Exact Mass190.11
IUPAC Name1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane
SMILESCOC1CCCC1C(C)(C)CCl
InChIInChI=1S/C10H19ClO/c1-10(2,7-11)8-5-4-6-9(8)12-3/h8-9H,4-7H2,1-3H3
InChIKeyWGVOLRLXTGAJDT-UHFFFAOYSA-N
XLogP3.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.71
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

trans-(1R,2S)-1-methoxy-2-(2-methylbutan-2-yl)cyclohexane
CID 149361841
cis-(1R,2S)-1,2-dimethoxycyclopentane
CID 21122335
1-methoxy-2-(trifluoromethyl)cyclohexane;hydrofluoride
CID 158258914
1-(2,2-dimethylpropyl)-2-methoxycyclohexane
CID 158846748
(2-methoxycyclopentyl)methanamine
CID 43428752
2-(2-methoxycyclopentyl)-2-methyl-3-oxobutanenitrile
CID 130587182
1-(1,1,1,3,3,3-hexafluoro-2-methoxypropan-2-yl)-2-methoxycyclohexane
CID 142016521
ethane;2-methoxycyclopentan-1-ol
CID 177178786
1-chloro-N-(2-methoxycyclopentyl)methanesulfonamide
CID 63665826
1-methoxy-2-propan-2-yloxycyclopentane
CID 77170188
cis-(1R,2R)-1-methoxy-2-propan-2-ylcyclopentane
CID 137449477
[2-(1-methoxy-2-methylpropan-2-yl)cyclopentyl] 2,2-dimethylbutanoate
CID 159843651

Frequently Asked Questions

What is the IUPAC name of 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane?
The IUPAC name of 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane (CID 130587203) is 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane.
What is the SMILES notation for 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane?
The canonical SMILES for 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane is COC1CCCC1C(C)(C)CCl.
What is the InChIKey of 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane?
The InChIKey is WGVOLRLXTGAJDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClO/c1-10(2,7-11)8-5-4-6-9(8)12-3/h8-9H,4-7H2,1-3H3.
What are the key properties of 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane?
1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane has a molecular weight of 190.71 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-chloro-2-methylpropan-2-yl)-2-methoxycyclopentane is sourced from PubChem (CID 130587203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).