6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol

C13H20N2O2 — CID 124528159

IUPAC6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CN[C@@H](C)[C@H]2CCCO2)n1
InChIInChI=1S/C13H20N2O2/c1-9-5-6-12(16)11(15-9)8-14-10(2)13-4-3-7-17-13/h5-6,10,13-14,16H,3-4,7-8H2,1-2H3/t10-,13+/m0/s1
InChIKeyHQSXHGIEXVQPEY-GXFFZTMASA-N
MW236.31 g/mol
LogP1.75
Rot. Bonds4

About 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol

6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol (PubChem CID 124528159) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol
PubChem CID124528159
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CN[C@@H](C)[C@H]2CCCO2)n1
InChIInChI=1S/C13H20N2O2/c1-9-5-6-12(16)11(15-9)8-14-10(2)13-4-3-7-17-13/h5-6,10,13-14,16H,3-4,7-8H2,1-2H3/t10-,13+/m0/s1
InChIKeyHQSXHGIEXVQPEY-GXFFZTMASA-N
XLogP1.75
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol with MolForge

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Related Compounds

N-[(4-methoxyphenyl)methyl]-1-(oxolan-2-yl)ethanamine
CID 43208412
N-[(3,4-dichlorophenyl)methyl]-1-(oxolan-2-yl)ethanamine
CID 43208415
5-methoxy-2-[[1-(oxolan-2-yl)ethylamino]methyl]phenol
CID 78969051
N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-1-(oxolan-2-yl)ethanamine
CID 82893205
2-[(cyclobutylamino)methyl]-6-methylpyridin-3-ol
CID 78950424
(1S)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-[(2S)-oxolan-2-yl]ethanamine
CID 93257811
N-[(3-methylphenyl)methyl]-1-(oxolan-2-yl)ethanamine
CID 43208430
4-[[1-(oxolan-2-yl)ethylamino]methyl]-1,3-thiazole-2-carboxylic acid
CID 103238624
N-[(4-tert-butylphenyl)methyl]-1-(oxolan-2-yl)ethanamine
CID 43111659
(1R)-N-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)methyl]-1-[(2S)-oxolan-2-yl]ethanamine
CID 99777491
N-[(3-chloro-4-methylphenyl)methyl]-1-(oxolan-2-yl)ethanamine
CID 106816198
6-methyl-2-[[1-(4-methylphenyl)ethylamino]methyl]pyridin-3-ol
CID 78928742

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol?
The IUPAC name of 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol (CID 124528159) is 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol?
The canonical SMILES for 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol is Cc1ccc(O)c(CN[C@@H](C)[C@H]2CCCO2)n1.
What is the InChIKey of 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol?
The InChIKey is HQSXHGIEXVQPEY-GXFFZTMASA-N. The full InChI is InChI=1S/C13H20N2O2/c1-9-5-6-12(16)11(15-9)8-14-10(2)13-4-3-7-17-13/h5-6,10,13-14,16H,3-4,7-8H2,1-2H3/t10-,13+/m0/s1.
What are the key properties of 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol?
6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol has a molecular weight of 236.31 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol is sourced from PubChem (CID 124528159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).