1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol

C12H24O2 — CID 115821425

IUPAC1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol
SMILESCCC1(C(O)COC(C)C)CCCC1
InChIInChI=1S/C12H24O2/c1-4-12(7-5-6-8-12)11(13)9-14-10(2)3/h10-11,13H,4-9H2,1-3H3
InChIKeyXCYSORDSMVYVQI-UHFFFAOYSA-N
MW200.32 g/mol
LogP2.74
Rot. Bonds5

About 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol

1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol (PubChem CID 115821425) has the molecular formula C12H24O2 and a molecular weight of 200.32 g/mol. Its IUPAC name is 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol.

Molecular Properties

Compound Name1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol
PubChem CID115821425
Molecular FormulaC12H24O2
Molecular Weight200.32 g/mol
Exact Mass200.18
IUPAC Name1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol
SMILESCCC1(C(O)COC(C)C)CCCC1
InChIInChI=1S/C12H24O2/c1-4-12(7-5-6-8-12)11(13)9-14-10(2)3/h10-11,13H,4-9H2,1-3H3
InChIKeyXCYSORDSMVYVQI-UHFFFAOYSA-N
XLogP2.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol
CID 106830958
N-[1-(1-ethylcyclopentyl)-2-propan-2-yloxyethyl]propan-1-amine
CID 105013427
1-(1-ethylcyclopentyl)-4,4,4-trifluorobutan-1-ol
CID 115808726
1-[1-(2-methylpropyl)cyclopentyl]-2-propan-2-yloxyethanamine
CID 105013085
(1-ethylcyclopentyl)-(3-methylcyclohexyl)methanol
CID 115808264
(1-ethylcyclopentyl)-(4-methylcyclohexyl)methanol
CID 115805271
1-(8-azaspiro[4.5]decan-8-yl)-3-propan-2-yloxypropan-2-ol
CID 63987208
1-[[(2-hydroxy-3-propan-2-yloxypropyl)amino]methyl]cyclopentan-1-ol
CID 65109325
1-[[(2-hydroxy-3-propan-2-yloxypropyl)amino]methyl]cycloheptan-1-ol
CID 65122217
1-(1-ethylcyclohexyl)-N-methylethanamine
CID 142438459
1-but-3-en-2-yl-1-ethylcyclopentane;propane
CID 145053026
1-ethyl-1-(propan-2-yloxymethyl)cyclopropane
CID 157344699

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol?
The IUPAC name of 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol (CID 115821425) is 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol.
What is the SMILES notation for 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol?
The canonical SMILES for 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol is CCC1(C(O)COC(C)C)CCCC1.
What is the InChIKey of 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol?
The InChIKey is XCYSORDSMVYVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2/c1-4-12(7-5-6-8-12)11(13)9-14-10(2)3/h10-11,13H,4-9H2,1-3H3.
What are the key properties of 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol?
1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol has a molecular weight of 200.32 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol is sourced from PubChem (CID 115821425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).