2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol

C10H14F2N2O2 — CID 107484208

IUPAC2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol
SMILESCOc1cccc(N(CCO)CC(F)F)n1
InChIInChI=1S/C10H14F2N2O2/c1-16-10-4-2-3-9(13-10)14(5-6-15)7-8(11)12/h2-4,8,15H,5-7H2,1H3
InChIKeyLKEJXCMBPBJDPT-UHFFFAOYSA-N
MW232.23 g/mol
LogP1.15
Rot. Bonds6

About 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol

2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol (PubChem CID 107484208) has the molecular formula C10H14F2N2O2 and a molecular weight of 232.23 g/mol. Its IUPAC name is 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol.

Molecular Properties

Compound Name2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol
PubChem CID107484208
Molecular FormulaC10H14F2N2O2
Molecular Weight232.23 g/mol
Exact Mass232.10
IUPAC Name2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol
SMILESCOc1cccc(N(CCO)CC(F)F)n1
InChIInChI=1S/C10H14F2N2O2/c1-16-10-4-2-3-9(13-10)14(5-6-15)7-8(11)12/h2-4,8,15H,5-7H2,1H3
InChIKeyLKEJXCMBPBJDPT-UHFFFAOYSA-N
XLogP1.15
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-amino-6-methoxy-2-pyridinyl)-(2,2-difluoroethyl)amino]ethanol
CID 107478117
6-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N'-hydroxypyridine-2-carboximidamide
CID 136858019
N,N-diethyl-6-methoxypyridin-2-amine
CID 118576477
methyl 2-[(2-methoxy-2-oxoethyl)-(6-methoxy-2-pyridinyl)amino]acetate
CID 63588742
N-(2-bromoethyl)-6-methoxy-N-propylpyridin-2-amine
CID 80673734
3-[ethyl-(6-methoxy-2-pyridinyl)amino]propanethioamide
CID 63591440
2-[butyl-(6-ethoxy-2-pyridinyl)amino]ethanol
CID 55212591
1-[ethyl-(6-methoxy-2-pyridinyl)amino]-2-methylpropan-2-ol
CID 79390079
2-[N-(2-hydroxyethyl)anilino]ethanol;(6-methoxy-2-pyridinyl)boronic acid
CID 160912215
N'-(6-methoxy-2-pyridinyl)-N-methyl-N'-propylethane-1,2-diamine
CID 63587227
N'-(6-methoxy-2-pyridinyl)-N'-methylethane-1,2-diamine
CID 63590609
N'-(2,2-difluoroethyl)-N'-(4-methoxypyrimidin-2-yl)ethane-1,2-diamine
CID 107493964

Frequently Asked Questions

What is the IUPAC name of 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol?
The IUPAC name of 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol (CID 107484208) is 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol.
What is the SMILES notation for 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol?
The canonical SMILES for 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol is COc1cccc(N(CCO)CC(F)F)n1.
What is the InChIKey of 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol?
The InChIKey is LKEJXCMBPBJDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2O2/c1-16-10-4-2-3-9(13-10)14(5-6-15)7-8(11)12/h2-4,8,15H,5-7H2,1H3.
What are the key properties of 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol?
2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol has a molecular weight of 232.23 g/mol, XLogP of 1.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,2-difluoroethyl-(6-methoxy-2-pyridinyl)amino]ethanol is sourced from PubChem (CID 107484208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).