[5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol

C14H22N2O — CID 113418057

IUPAC[5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol
SMILESCCCC1CCN(c2ncc(CO)cc2C)C1
InChIInChI=1S/C14H22N2O/c1-3-4-12-5-6-16(9-12)14-11(2)7-13(10-17)8-15-14/h7-8,12,17H,3-6,9-10H2,1-2H3
InChIKeyKTCBIJQBNFUVKR-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.51
Rot. Bonds4

About [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol

[5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol (PubChem CID 113418057) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol
PubChem CID113418057
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol
SMILESCCCC1CCN(c2ncc(CO)cc2C)C1
InChIInChI=1S/C14H22N2O/c1-3-4-12-5-6-16(9-12)14-11(2)7-13(10-17)8-15-14/h7-8,12,17H,3-6,9-10H2,1-2H3
InChIKeyKTCBIJQBNFUVKR-UHFFFAOYSA-N
XLogP2.51
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(bromomethyl)-3-methyl-2-(3-propylpyrrolidin-1-yl)pyridine
CID 107085109
2-[1-[5-[(tert-butylamino)methyl]-3-methyl-2-pyridinyl]pyrrolidin-3-yl]ethanol
CID 114798609
[5-methyl-6-(3-methylazetidin-1-yl)-3-pyridinyl]methanol
CID 164658279
[6-(4-tert-butylpiperidin-1-yl)-5-methyl-3-pyridinyl]methanol
CID 80628617
[5-methyl-6-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-3-pyridinyl]methanol
CID 81199999
[6-(azepan-1-yl)-5-methyl-3-pyridinyl]methanol
CID 79884523
[1-[5-(ethylaminomethyl)-3-methyl-2-pyridinyl]piperidin-4-yl]methanol
CID 80629576
[5-methyl-6-[3-(trifluoromethyl)piperidin-1-yl]-3-pyridinyl]methanol
CID 80628917
[1-[5-(ethylaminomethyl)-3-methyl-2-pyridinyl]piperidin-3-yl]methanol
CID 80630100
[6-(4-propylpiperidin-1-yl)-3-pyridinyl]methanol
CID 62205775
2-[1-[3-methyl-5-[(propan-2-ylamino)methyl]-2-pyridinyl]piperidin-3-yl]ethanol
CID 107228161
[6-(4-ethylpiperidin-1-yl)-5-methyl-3-pyridinyl]methanamine
CID 80630113

Frequently Asked Questions

What is the IUPAC name of [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol?
The IUPAC name of [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol (CID 113418057) is [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol?
The canonical SMILES for [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol is CCCC1CCN(c2ncc(CO)cc2C)C1.
What is the InChIKey of [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol?
The InChIKey is KTCBIJQBNFUVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-3-4-12-5-6-16(9-12)14-11(2)7-13(10-17)8-15-14/h7-8,12,17H,3-6,9-10H2,1-2H3.
What are the key properties of [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol?
[5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol has a molecular weight of 234.34 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-6-(3-propylpyrrolidin-1-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 113418057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).