(1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol

C10H14F2N2O — CID 104871019

IUPAC(1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol
SMILESC[C@@H](O)c1ccc(N(C)CC(F)F)cn1
InChIInChI=1S/C10H14F2N2O/c1-7(15)9-4-3-8(5-13-9)14(2)6-10(11)12/h3-5,7,10,15H,6H2,1-2H3/t7-/m1/s1
InChIKeyQVLVAOPAEHNBSN-SSDOTTSWSA-N
MW216.23 g/mol
LogP1.84
Rot. Bonds4

About (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol

(1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol (PubChem CID 104871019) has the molecular formula C10H14F2N2O and a molecular weight of 216.23 g/mol. Its IUPAC name is (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol
PubChem CID104871019
Molecular FormulaC10H14F2N2O
Molecular Weight216.23 g/mol
Exact Mass216.11
IUPAC Name(1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol
SMILESC[C@@H](O)c1ccc(N(C)CC(F)F)cn1
InChIInChI=1S/C10H14F2N2O/c1-7(15)9-4-3-8(5-13-9)14(2)6-10(11)12/h3-5,7,10,15H,6H2,1-2H3/t7-/m1/s1
InChIKeyQVLVAOPAEHNBSN-SSDOTTSWSA-N
XLogP1.84
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.23
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[5-[(4-fluorophenyl)methyl-methylamino]-2-pyridinyl]ethanol
CID 83131523
(1S)-1-[5-[methyl(prop-2-ynyl)amino]-2-pyridinyl]ethanol
CID 83132268
(1R)-1-[5-[methyl(prop-2-enyl)amino]-2-pyridinyl]ethanol
CID 83132695
(1S)-1-[5-[methyl-[(4-methylphenyl)methyl]amino]-2-pyridinyl]ethanol
CID 83132028
(1R)-1-[5-[cyclopropylmethyl(methyl)amino]-2-pyridinyl]ethanol
CID 83132456
(1R)-1-[5-[methyl(pentan-2-yl)amino]-2-pyridinyl]ethanol
CID 83131859
3-[[6-(1-hydroxyethyl)-3-pyridinyl]-methylamino]propanenitrile
CID 83131425
(1R)-1-[5-[3-methoxypropyl(methyl)amino]-2-pyridinyl]ethanol
CID 83132161
1-[5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-pyridinyl]ethanol
CID 103189789
(1S)-1-[5-[methyl(pyridin-3-ylmethyl)amino]-2-pyridinyl]ethanol
CID 83132034
(1S)-1-[5-[(4-methoxyphenyl)methyl-methylamino]-2-pyridinyl]ethanol
CID 83131957
(1S)-1-[5-[methyl(pent-4-enyl)amino]-2-pyridinyl]ethanol
CID 104869711

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol (CID 104871019) is (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol is C[C@@H](O)c1ccc(N(C)CC(F)F)cn1.
What is the InChIKey of (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol?
The InChIKey is QVLVAOPAEHNBSN-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H14F2N2O/c1-7(15)9-4-3-8(5-13-9)14(2)6-10(11)12/h3-5,7,10,15H,6H2,1-2H3/t7-/m1/s1.
What are the key properties of (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol?
(1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol has a molecular weight of 216.23 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-[2,2-difluoroethyl(methyl)amino]-2-pyridinyl]ethanol is sourced from PubChem (CID 104871019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).