[2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol

C14H22N2O — CID 113418483

IUPAC[2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
SMILESCCC1CCN(c2nc(C)cc(C)c2CO)C1
InChIInChI=1S/C14H22N2O/c1-4-12-5-6-16(8-12)14-13(9-17)10(2)7-11(3)15-14/h7,12,17H,4-6,8-9H2,1-3H3
InChIKeyAWKLIQPKLQFKGO-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.43
Rot. Bonds3

About [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol

[2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol (PubChem CID 113418483) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
PubChem CID113418483
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
SMILESCCC1CCN(c2nc(C)cc(C)c2CO)C1
InChIInChI=1S/C14H22N2O/c1-4-12-5-6-16(8-12)14-13(9-17)10(2)7-11(3)15-14/h7,12,17H,4-6,8-9H2,1-3H3
InChIKeyAWKLIQPKLQFKGO-UHFFFAOYSA-N
XLogP2.43
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-4,6-dimethyl-3-pyridinyl]methanol
CID 61255839
[4,6-dimethyl-2-(4-methylazepan-1-yl)-3-pyridinyl]methanol
CID 63622827
[2-(3,4-dimethylpiperazin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
CID 55218131
1-[2-(4-ethylpiperidin-1-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
CID 62289434
N-[[2-(4-ethylpiperidin-1-yl)-4,6-dimethyl-3-pyridinyl]methyl]propan-1-amine
CID 62289436
[2-(4-cyclopropylpiperazin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
CID 61445464
[2-(2-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
CID 61254337
1-[3-(aminomethyl)-4,6-dimethyl-2-pyridinyl]-3-methylpiperidin-4-ol
CID 114677807
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4,6-dimethyl-3-pyridinyl]methanol
CID 61252617
[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-3-yl]methanol
CID 62373112
N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 62285741
2-(3-ethylpyrrolidin-1-yl)-N'-hydroxy-6-methylpyrimidine-4-carboximidamide
CID 136906910

Frequently Asked Questions

What is the IUPAC name of [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol?
The IUPAC name of [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol (CID 113418483) is [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol.
What is the SMILES notation for [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol?
The canonical SMILES for [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol is CCC1CCN(c2nc(C)cc(C)c2CO)C1.
What is the InChIKey of [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol?
The InChIKey is AWKLIQPKLQFKGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-12-5-6-16(8-12)14-13(9-17)10(2)7-11(3)15-14/h7,12,17H,4-6,8-9H2,1-3H3.
What are the key properties of [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol?
[2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol has a molecular weight of 234.34 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol is sourced from PubChem (CID 113418483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).