2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol

C10H14F2N2O2 — CID 107484642

IUPAC2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol
SMILESOCCN(CC(F)F)c1ncccc1CO
InChIInChI=1S/C10H14F2N2O2/c11-9(12)6-14(4-5-15)10-8(7-16)2-1-3-13-10/h1-3,9,15-16H,4-7H2
InChIKeyVULFPTDDDPBOIB-UHFFFAOYSA-N
MW232.23 g/mol
LogP0.64
Rot. Bonds6

About 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol

2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol (PubChem CID 107484642) has the molecular formula C10H14F2N2O2 and a molecular weight of 232.23 g/mol. Its IUPAC name is 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol.

Molecular Properties

Compound Name2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol
PubChem CID107484642
Molecular FormulaC10H14F2N2O2
Molecular Weight232.23 g/mol
Exact Mass232.10
IUPAC Name2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol
SMILESOCCN(CC(F)F)c1ncccc1CO
InChIInChI=1S/C10H14F2N2O2/c11-9(12)6-14(4-5-15)10-8(7-16)2-1-3-13-10/h1-3,9,15-16H,4-7H2
InChIKeyVULFPTDDDPBOIB-UHFFFAOYSA-N
XLogP0.64
TPSA56.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.23
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[3-(aminomethyl)-2-pyridinyl]-(2,2-difluoroethyl)amino]ethanol
CID 107478427
2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N'-hydroxypyridine-3-carboximidamide
CID 107480051
N-(2-bromoethyl)-N-(2,2-difluoroethyl)-3-fluoropyridin-2-amine
CID 107489652
3-chloro-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carbonitrile
CID 107479563
3-[2,2-difluoroethyl(2-hydroxyethyl)amino]-1-methylpyrazin-2-one
CID 107484278
N'-(3-bromo-2-pyridinyl)-N'-(2,2-difluoroethyl)ethane-1,2-diamine
CID 107494126
2-[2,2-difluoroethyl-[5-(hydroxymethyl)-2-pyridinyl]amino]ethanol
CID 107481030
[2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol
CID 82960882
2-[[4-(aminomethyl)pyrimidin-2-yl]-(2,2-difluoroethyl)amino]ethanol
CID 107542342
2-[2,2-difluoroethyl-[2-(methylamino)quinazolin-4-yl]amino]ethanol
CID 107495123
2-[2,2-difluoroethyl-[2-(methylamino)-4-pyridinyl]amino]ethanol
CID 107495109
[2-[methyl(propyl)amino]-3-pyridinyl]methanol
CID 61255175

Frequently Asked Questions

What is the IUPAC name of 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol?
The IUPAC name of 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol (CID 107484642) is 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol.
What is the SMILES notation for 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol?
The canonical SMILES for 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol is OCCN(CC(F)F)c1ncccc1CO.
What is the InChIKey of 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol?
The InChIKey is VULFPTDDDPBOIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2O2/c11-9(12)6-14(4-5-15)10-8(7-16)2-1-3-13-10/h1-3,9,15-16H,4-7H2.
What are the key properties of 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol?
2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol has a molecular weight of 232.23 g/mol, XLogP of 0.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol is sourced from PubChem (CID 107484642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).