1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol

C14H21NO — CID 107186175

IUPAC1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol
SMILESCc1ccc(CC(O)C2CCCC2C)nc1
InChIInChI=1S/C14H21NO/c1-10-6-7-12(15-9-10)8-14(16)13-5-3-4-11(13)2/h6-7,9,11,13-14,16H,3-5,8H2,1-2H3
InChIKeyHPAYVPMXHSRPHS-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.73
Rot. Bonds3

About 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol

1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol (PubChem CID 107186175) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol
PubChem CID107186175
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol
SMILESCc1ccc(CC(O)C2CCCC2C)nc1
InChIInChI=1S/C14H21NO/c1-10-6-7-12(15-9-10)8-14(16)13-5-3-4-11(13)2/h6-7,9,11,13-14,16H,3-5,8H2,1-2H3
InChIKeyHPAYVPMXHSRPHS-UHFFFAOYSA-N
XLogP2.73
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol?
The IUPAC name of 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol (CID 107186175) is 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol.
What is the SMILES notation for 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol?
The canonical SMILES for 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol is Cc1ccc(CC(O)C2CCCC2C)nc1.
What is the InChIKey of 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol?
The InChIKey is HPAYVPMXHSRPHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-6-7-12(15-9-10)8-14(16)13-5-3-4-11(13)2/h6-7,9,11,13-14,16H,3-5,8H2,1-2H3.
What are the key properties of 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol?
1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol has a molecular weight of 219.33 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol is sourced from PubChem (CID 107186175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).