(1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol

C16H19FN2O — CID 97136684

IUPAC(1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol
SMILESC[C@H](c1ccccn1)N(C)C[C@H](O)c1ccccc1F
InChIInChI=1S/C16H19FN2O/c1-12(15-9-5-6-10-18-15)19(2)11-16(20)13-7-3-4-8-14(13)17/h3-10,12,16,20H,11H2,1-2H3/t12-,16+/m1/s1
InChIKeyVNRSHCIVJBTVTG-WBMJQRKESA-N
MW274.34 g/mol
LogP2.95
Rot. Bonds5

About (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol

(1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol (PubChem CID 97136684) has the molecular formula C16H19FN2O and a molecular weight of 274.34 g/mol. Its IUPAC name is (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol.

Molecular Properties

Compound Name(1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol
PubChem CID97136684
Molecular FormulaC16H19FN2O
Molecular Weight274.34 g/mol
Exact Mass274.15
IUPAC Name(1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol
SMILESC[C@H](c1ccccn1)N(C)C[C@H](O)c1ccccc1F
InChIInChI=1S/C16H19FN2O/c1-12(15-9-5-6-10-18-15)19(2)11-16(20)13-7-3-4-8-14(13)17/h3-10,12,16,20H,11H2,1-2H3/t12-,16+/m1/s1
InChIKeyVNRSHCIVJBTVTG-WBMJQRKESA-N
XLogP2.95
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2-fluorophenyl)ethyl-methylamino]-1-(2-methylphenyl)ethanol
CID 62983990
2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid
CID 95935067
1-[1-(2-fluorophenyl)ethyl-methylamino]-3,3-dimethylbutan-2-ol
CID 55139894
3-[methyl(1-pyridin-2-ylethyl)amino]propanoic acid
CID 65063476
(2S)-2-(2-fluorophenyl)-2-pyridin-2-ylethanamine
CID 39243625
2-(2-fluorophenyl)-N-methyl-2-pyridin-2-ylethanamine
CID 116824647
1-(2-fluorophenyl)-3-[2-hydroxypropyl(methyl)amino]propan-1-ol
CID 62630697
1-(2,5-difluorophenyl)-2-(1-pyridin-2-ylethylamino)ethanol
CID 60909735
(1S)-1-[2-(2-fluoro-N-methylanilino)-3-pyridinyl]ethanol
CID 114056037
(1S)-2-chloro-1-(2-fluorophenyl)ethanol
CID 83001661
1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine
CID 15806675
1-(2-fluorophenyl)-N-methyl-1-pyridin-2-ylmethanamine
CID 62500784

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol?
The IUPAC name of (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol (CID 97136684) is (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol.
What is the SMILES notation for (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol?
The canonical SMILES for (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol is C[C@H](c1ccccn1)N(C)C[C@H](O)c1ccccc1F.
What is the InChIKey of (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol?
The InChIKey is VNRSHCIVJBTVTG-WBMJQRKESA-N. The full InChI is InChI=1S/C16H19FN2O/c1-12(15-9-5-6-10-18-15)19(2)11-16(20)13-7-3-4-8-14(13)17/h3-10,12,16,20H,11H2,1-2H3/t12-,16+/m1/s1.
What are the key properties of (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol?
(1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol has a molecular weight of 274.34 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-fluorophenyl)-2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]ethanol is sourced from PubChem (CID 97136684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).