1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol

C15H21NO — CID 112745195

IUPAC1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol
SMILESCc1ccc(CC(O)C(C2CC2)C2CC2)nc1
InChIInChI=1S/C15H21NO/c1-10-2-7-13(16-9-10)8-14(17)15(11-3-4-11)12-5-6-12/h2,7,9,11-12,14-15,17H,3-6,8H2,1H3
InChIKeySWDAXLCNYLSFIM-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.73
Rot. Bonds5

About 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol

1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol (PubChem CID 112745195) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol
PubChem CID112745195
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol
SMILESCc1ccc(CC(O)C(C2CC2)C2CC2)nc1
InChIInChI=1S/C15H21NO/c1-10-2-7-13(16-9-10)8-14(17)15(11-3-4-11)12-5-6-12/h2,7,9,11-12,14-15,17H,3-6,8H2,1H3
InChIKeySWDAXLCNYLSFIM-UHFFFAOYSA-N
XLogP2.73
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol
CID 107186175
1-cyclopentyl-2-(5-methyl-2-pyridinyl)ethanamine
CID 66446145
1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine
CID 66446718
1-cyclobutyl-N-ethyl-3-(5-methyl-2-pyridinyl)propan-2-amine
CID 103164343
1-amino-3-(5-methyl-2-pyridinyl)propan-2-ol
CID 83442584
3-(5-bromo-2-pyridinyl)-1-cyclopropylpropane-1,2-diol
CID 103456719
2-[2-(4-tert-butylcyclohexyl)-2-chloroethyl]-5-methylpyridine
CID 66461420
5-methyl-2-[(2S)-2-methylbutyl]pyridine
CID 118944951
1-cyclohexyl-3-(5-methyl-2-pyridinyl)-N-propylpropan-2-amine
CID 66446739
1-(5-methyl-2-pyridinyl)-4-(oxolan-2-yl)butan-2-ol
CID 66461132
2-[2-bromo-4-(oxolan-2-yl)butyl]-5-methylpyridine
CID 66454874
3,3-dimethyl-1-(5-methyl-2-pyridinyl)pentan-2-ol
CID 66459924

Frequently Asked Questions

What is the IUPAC name of 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol?
The IUPAC name of 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol (CID 112745195) is 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol.
What is the SMILES notation for 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol?
The canonical SMILES for 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol is Cc1ccc(CC(O)C(C2CC2)C2CC2)nc1.
What is the InChIKey of 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol?
The InChIKey is SWDAXLCNYLSFIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-10-2-7-13(16-9-10)8-14(17)15(11-3-4-11)12-5-6-12/h2,7,9,11-12,14-15,17H,3-6,8H2,1H3.
What are the key properties of 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol?
1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol has a molecular weight of 231.34 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol is sourced from PubChem (CID 112745195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).