1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol

C13H20N2O — CID 112585309

IUPAC1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol
SMILESCCC(O)c1ccc(N2CCC(C)C2)cn1
InChIInChI=1S/C13H20N2O/c1-3-13(16)12-5-4-11(8-14-12)15-7-6-10(2)9-15/h4-5,8,10,13,16H,3,6-7,9H2,1-2H3
InChIKeySGMUDGIDEQFMNY-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.37
Rot. Bonds3

About 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol

1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol (PubChem CID 112585309) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol
PubChem CID112585309
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol
SMILESCCC(O)c1ccc(N2CCC(C)C2)cn1
InChIInChI=1S/C13H20N2O/c1-3-13(16)12-5-4-11(8-14-12)15-7-6-10(2)9-15/h4-5,8,10,13,16H,3,6-7,9H2,1-2H3
InChIKeySGMUDGIDEQFMNY-UHFFFAOYSA-N
XLogP2.37
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-ol
CID 112585215
1-[6-(1-hydroxypropyl)-3-pyridinyl]-4-methylpiperidin-3-ol
CID 102959840
(1R)-1-[5-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-2-pyridinyl]propan-1-ol
CID 113356003
1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 112584254
(1S)-1-[5-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-2-pyridinyl]propan-1-ol
CID 103938404
(1S)-1-[5-(3-methoxy-4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-ol
CID 102959932
(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanol
CID 83132436
1-[6-[(1S)-1-hydroxypropyl]-3-pyridinyl]-N-methylpiperidine-4-carboxamide
CID 103938495
1-[6-(1-hydroxypropyl)-3-pyridinyl]-N-methylpiperidine-4-carboxamide
CID 115940404
1-[5-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-2-pyridinyl]propan-1-ol
CID 115940504
(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine
CID 103936871
(1R)-1-[5-(4-cyclopentylpiperazin-1-yl)-2-pyridinyl]propan-1-ol
CID 103938687

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol?
The IUPAC name of 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol (CID 112585309) is 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol.
What is the SMILES notation for 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol?
The canonical SMILES for 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol is CCC(O)c1ccc(N2CCC(C)C2)cn1.
What is the InChIKey of 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol?
The InChIKey is SGMUDGIDEQFMNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-3-13(16)12-5-4-11(8-14-12)15-7-6-10(2)9-15/h4-5,8,10,13,16H,3,6-7,9H2,1-2H3.
What are the key properties of 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol?
1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol has a molecular weight of 220.32 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 112585309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).