1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol

C13H20N2O2 — CID 82742695

IUPAC1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol
SMILESCC(O)c1ccc(N(C)C2CCOC2C)nc1
InChIInChI=1S/C13H20N2O2/c1-9(16)11-4-5-13(14-8-11)15(3)12-6-7-17-10(12)2/h4-5,8-10,12,16H,6-7H2,1-3H3
InChIKeyXGHJKEAYQNZAAR-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.75
Rot. Bonds3

About 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol

1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol (PubChem CID 82742695) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol.

Molecular Properties

Compound Name1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol
PubChem CID82742695
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol
SMILESCC(O)c1ccc(N(C)C2CCOC2C)nc1
InChIInChI=1S/C13H20N2O2/c1-9(16)11-4-5-13(14-8-11)15(3)12-6-7-17-10(12)2/h4-5,8-10,12,16H,6-7H2,1-3H3
InChIKeyXGHJKEAYQNZAAR-UHFFFAOYSA-N
XLogP1.75
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(2-methyloxolan-3-yl)-5-[1-(propylamino)ethyl]pyridin-2-amine
CID 82740348
(1S)-1-[3-chloro-4-[methyl-(2-methyloxolan-3-yl)amino]phenyl]ethanol
CID 82742935
(1R)-1-[2-[methyl-(2-methyloxolan-3-yl)amino]phenyl]ethanol
CID 82742779
N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine
CID 20811607
N-methyl-N-(2-methyloxolan-3-yl)-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 82754507
1-[3-fluoro-2-[methyl-(2-methyloxolan-3-yl)amino]phenyl]ethanol
CID 114059222
1-[5-bromo-2-[methyl-(2-methyloxolan-3-yl)amino]phenyl]ethanol
CID 82971312
N,6-dimethyl-N-(2-methyloxolan-3-yl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 82754773
4-N,6-N-dimethyl-4-N-(2-methyloxolan-3-yl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 82744642
2-N,4-N,5-trimethyl-4-N-(2-methyloxolan-3-yl)pyrimidine-2,4-diamine
CID 82744646
4-[methyl-(2-methyloxolan-3-yl)amino]butan-2-ol
CID 82748524
N-methyl-N-(2-methyloxolan-3-yl)-5-(propylaminomethyl)pyrazin-2-amine
CID 107380700

Frequently Asked Questions

What is the IUPAC name of 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol?
The IUPAC name of 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol (CID 82742695) is 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol.
What is the SMILES notation for 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol?
The canonical SMILES for 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol is CC(O)c1ccc(N(C)C2CCOC2C)nc1.
What is the InChIKey of 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol?
The InChIKey is XGHJKEAYQNZAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-9(16)11-4-5-13(14-8-11)15(3)12-6-7-17-10(12)2/h4-5,8-10,12,16H,6-7H2,1-3H3.
What are the key properties of 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol?
1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol has a molecular weight of 236.31 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[methyl-(2-methyloxolan-3-yl)amino]-3-pyridinyl]ethanol is sourced from PubChem (CID 82742695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).