1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol

C12H17NO — CID 66460705

IUPAC1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol
SMILESCc1cccnc1CC(O)C1CC1C
InChIInChI=1S/C12H17NO/c1-8-4-3-5-13-11(8)7-12(14)10-6-9(10)2/h3-5,9-10,12,14H,6-7H2,1-2H3
InChIKeyMVWFCYBIKMBHLI-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.95
Rot. Bonds3

About 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol

1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol (PubChem CID 66460705) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol
PubChem CID66460705
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol
SMILESCc1cccnc1CC(O)C1CC1C
InChIInChI=1S/C12H17NO/c1-8-4-3-5-13-11(8)7-12(14)10-6-9(10)2/h3-5,9-10,12,14H,6-7H2,1-2H3
InChIKeyMVWFCYBIKMBHLI-UHFFFAOYSA-N
XLogP1.95
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol?
The IUPAC name of 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol (CID 66460705) is 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol.
What is the SMILES notation for 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol?
The canonical SMILES for 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol is Cc1cccnc1CC(O)C1CC1C.
What is the InChIKey of 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol?
The InChIKey is MVWFCYBIKMBHLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-8-4-3-5-13-11(8)7-12(14)10-6-9(10)2/h3-5,9-10,12,14H,6-7H2,1-2H3.
What are the key properties of 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol?
1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol has a molecular weight of 191.27 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopropyl)-2-(3-methyl-2-pyridinyl)ethanol is sourced from PubChem (CID 66460705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).