[2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol

C15H24N2O — CID 113380527

IUPAC[2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol
SMILESCC(C)c1cc(CO)cc(N2CCC(C)(C)C2)n1
InChIInChI=1S/C15H24N2O/c1-11(2)13-7-12(9-18)8-14(16-13)17-6-5-15(3,4)10-17/h7-8,11,18H,5-6,9-10H2,1-4H3
InChIKeyZWJPGBXOLZJSKB-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.93
Rot. Bonds3

About [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol

[2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol (PubChem CID 113380527) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol
PubChem CID113380527
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name[2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol
SMILESCC(C)c1cc(CO)cc(N2CCC(C)(C)C2)n1
InChIInChI=1S/C15H24N2O/c1-11(2)13-7-12(9-18)8-14(16-13)17-6-5-15(3,4)10-17/h7-8,11,18H,5-6,9-10H2,1-4H3
InChIKeyZWJPGBXOLZJSKB-UHFFFAOYSA-N
XLogP2.93
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-(chloromethyl)-6-propan-2-yl-2-pyridinyl]-7,7-dimethyl-1,4-thiazepane
CID 107458292
6-(3,3-dimethylpyrrolidin-1-yl)-N-ethyl-2-propan-2-ylpyrimidin-4-amine
CID 80959385
[2-(2-ethylazepan-1-yl)-6-propan-2-yl-4-pyridinyl]methanol
CID 104691301
6-(3,3-dimethylpyrrolidin-1-yl)-2-methylpyrimidin-4-amine
CID 80855443
4-[4-(chloromethyl)-6-propan-2-yl-2-pyridinyl]-1,2,6-trimethylpiperazine
CID 114538908
2-tert-butyl-4-chloro-6-(3,3-dimethylpyrrolidin-1-yl)pyrimidine
CID 80951390
[2-(3,4-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine
CID 113381419
6-(3,3-dimethylpyrrolidin-1-yl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
CID 102718915
1-[6-(3,3-dimethylpyrrolidin-1-yl)-3-pyridinyl]propan-2-amine
CID 80635207
3-methyl-1-(6-propan-2-ylpyrimidin-4-yl)pyrrolidin-3-ol
CID 103725176
[2-(azocan-1-yl)-6-methyl-4-pyridinyl]methanol
CID 113378723
[2-(3,4-dimethoxypyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanamine
CID 103539567

Frequently Asked Questions

What is the IUPAC name of [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol?
The IUPAC name of [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol (CID 113380527) is [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol.
What is the SMILES notation for [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol?
The canonical SMILES for [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol is CC(C)c1cc(CO)cc(N2CCC(C)(C)C2)n1.
What is the InChIKey of [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol?
The InChIKey is ZWJPGBXOLZJSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(2)13-7-12(9-18)8-14(16-13)17-6-5-15(3,4)10-17/h7-8,11,18H,5-6,9-10H2,1-4H3.
What are the key properties of [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol?
[2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol has a molecular weight of 248.37 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,3-dimethylpyrrolidin-1-yl)-6-propan-2-yl-4-pyridinyl]methanol is sourced from PubChem (CID 113380527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).