(1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol

C13H20N2O2 — CID 114055895

IUPAC(1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol
SMILESC[C@H](O)c1cccnc1N(C)CC1CCCO1
InChIInChI=1S/C13H20N2O2/c1-10(16)12-6-3-7-14-13(12)15(2)9-11-5-4-8-17-11/h3,6-7,10-11,16H,4-5,8-9H2,1-2H3/t10-,11?/m0/s1
InChIKeyDCDBVIFMYVRBIN-VUWPPUDQSA-N
MW236.31 g/mol
LogP1.75
Rot. Bonds4

About (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol

(1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol (PubChem CID 114055895) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol
PubChem CID114055895
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name(1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol
SMILESC[C@H](O)c1cccnc1N(C)CC1CCCO1
InChIInChI=1S/C13H20N2O2/c1-10(16)12-6-3-7-14-13(12)15(2)9-11-5-4-8-17-11/h3,6-7,10-11,16H,4-5,8-9H2,1-2H3/t10-,11?/m0/s1
InChIKeyDCDBVIFMYVRBIN-VUWPPUDQSA-N
XLogP1.75
TPSA45.59 Ų
H-Bond Donors1
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 ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[methyl(oxan-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 61222214
[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 131942429
N'-hydroxy-2-[methyl(oxan-2-ylmethyl)amino]pyridine-3-carboximidamide
CID 61432324
(1S)-1-[2-[bis(cyclopropylmethyl)amino]-3-pyridinyl]ethanol
CID 114056124
1-[2-[cycloheptyl(methyl)amino]-3-pyridinyl]ethanol
CID 114055853
1-[2-[cyclobutyl(2-hydroxyethyl)amino]-3-pyridinyl]ethanol
CID 114056274
N-cyclopropyl-2-[[3-[(1S)-1-hydroxyethyl]-2-pyridinyl]-methylamino]acetamide
CID 114055994
6-chloro-N-methyl-N-(oxolan-2-ylmethyl)-5-propan-2-ylpyrimidin-4-amine
CID 63728796
(1R)-1-[2-(oxolan-2-ylmethylsulfanyl)phenyl]ethanol
CID 106496640
2-N,2-N-dimethyl-3-N-(oxolan-2-ylmethyl)pyridine-2,3-diamine
CID 82834810
1-[2-[methyl(oxan-2-ylmethyl)amino]-1,3-thiazol-5-yl]ethanol
CID 62753865
2-N,4-N,5-trimethyl-2-N,4-N-bis[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4-diamine
CID 124859594

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol?
The IUPAC name of (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol (CID 114055895) is (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol.
What is the SMILES notation for (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol?
The canonical SMILES for (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol is C[C@H](O)c1cccnc1N(C)CC1CCCO1.
What is the InChIKey of (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol?
The InChIKey is DCDBVIFMYVRBIN-VUWPPUDQSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(16)12-6-3-7-14-13(12)15(2)9-11-5-4-8-17-11/h3,6-7,10-11,16H,4-5,8-9H2,1-2H3/t10-,11?/m0/s1.
What are the key properties of (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol?
(1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol has a molecular weight of 236.31 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[2-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]ethanol is sourced from PubChem (CID 114055895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).