2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol

C11H15NO2 — CID 116712495

IUPAC2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol
SMILESCOC(C1CC1)C(O)c1cccnc1
InChIInChI=1S/C11H15NO2/c1-14-11(8-4-5-8)10(13)9-3-2-6-12-7-9/h2-3,6-8,10-11,13H,4-5H2,1H3
InChIKeyYCTMUVZKYFSNLH-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.54
Rot. Bonds4

About 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol

2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol (PubChem CID 116712495) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol.

Molecular Properties

Compound Name2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol
PubChem CID116712495
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol
SMILESCOC(C1CC1)C(O)c1cccnc1
InChIInChI=1S/C11H15NO2/c1-14-11(8-4-5-8)10(13)9-3-2-6-12-7-9/h2-3,6-8,10-11,13H,4-5H2,1H3
InChIKeyYCTMUVZKYFSNLH-UHFFFAOYSA-N
XLogP1.54
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-2-methoxy-1-(3-methoxyphenyl)ethanol
CID 116712494
1-(3-chlorophenyl)-2-cyclopropyl-2-methoxyethanol
CID 116712514
methyl (2S)-2-cyclopentyl-2-pyridin-3-ylacetate
CID 129395618
2-cyclopropyl-1-(3,4-difluorophenyl)-2-methoxyethanol
CID 116712647
1-amino-4-cyclopropyl-2-pyridin-3-ylpentan-3-ol
CID 83149883
N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
CID 26385082
2-cyclohexyl-1-pyridin-3-ylethanol
CID 22768104
(1R)-1-cyclopropyl-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
CID 28655253
2-cyclohexyl-2-methoxy-1-[4-(trifluoromethyl)-3-pyridinyl]ethanol
CID 102707932
3-(4-amino-3-pyridinyl)-1-cyclopropyl-1-methoxypropan-2-ol
CID 116712449
methyl 2-(cyclopropylamino)-2-pyridin-3-ylacetate
CID 60795276
[1-(dimethylamino)-4-methylcyclohexyl]-pyridin-3-ylmethanol
CID 79074201

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol?
The IUPAC name of 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol (CID 116712495) is 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol.
What is the SMILES notation for 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol?
The canonical SMILES for 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol is COC(C1CC1)C(O)c1cccnc1.
What is the InChIKey of 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol?
The InChIKey is YCTMUVZKYFSNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-14-11(8-4-5-8)10(13)9-3-2-6-12-7-9/h2-3,6-8,10-11,13H,4-5H2,1H3.
What are the key properties of 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol?
2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol has a molecular weight of 193.25 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methoxy-1-pyridin-3-ylethanol is sourced from PubChem (CID 116712495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).