(2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol

C12H18N2O2 — CID 131869094

IUPAC(2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol
SMILESN[C@H](CO)c1cccnc1OC1CCCC1
InChIInChI=1S/C12H18N2O2/c13-11(8-15)10-6-3-7-14-12(10)16-9-4-1-2-5-9/h3,6-7,9,11,15H,1-2,4-5,8,13H2/t11-/m1/s1
InChIKeyRCLVBGRTQVLMJU-LLVKDONJSA-N
MW222.29 g/mol
LogP1.40
Rot. Bonds4

About (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol

(2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol (PubChem CID 131869094) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol.

Molecular Properties

Compound Name(2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol
PubChem CID131869094
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name(2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol
SMILESN[C@H](CO)c1cccnc1OC1CCCC1
InChIInChI=1S/C12H18N2O2/c13-11(8-15)10-6-3-7-14-12(10)16-9-4-1-2-5-9/h3,6-7,9,11,15H,1-2,4-5,8,13H2/t11-/m1/s1
InChIKeyRCLVBGRTQVLMJU-LLVKDONJSA-N
XLogP1.40
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-(2-cyclopentyloxy-3-pyridinyl)ethanamine
CID 103695133
2-cyclopentyloxy-3-propan-2-ylpyridine
CID 164786462
2-amino-2-(2-ethoxy-3-pyridinyl)ethanol
CID 55294211
2-cyclopentyloxypyridine-3-carbothioamide
CID 24707361
2-cyclopentyloxy-3-fluoropyridine
CID 126955068
(2S)-2-amino-2-(2-methyl-3-pyridinyl)ethanol
CID 55263472
(2S)-2-amino-2-(2-bromo-3-pyridinyl)ethanol
CID 130865139
1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]ethanamine
CID 114056592
2-cyclohexyloxypyridine-3-carbaldehyde
CID 42553139
2-amino-2-(6-cyclobutyloxy-3-pyridinyl)ethanol
CID 71183010
2-cyclopropyl-1-(2-methoxy-3-pyridinyl)ethanamine
CID 55297501
(E)-3-(2-cyclopentyloxy-3-pyridinyl)prop-2-enamide
CID 170877006

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol?
The IUPAC name of (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol (CID 131869094) is (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol.
What is the SMILES notation for (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol?
The canonical SMILES for (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol is N[C@H](CO)c1cccnc1OC1CCCC1.
What is the InChIKey of (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol?
The InChIKey is RCLVBGRTQVLMJU-LLVKDONJSA-N. The full InChI is InChI=1S/C12H18N2O2/c13-11(8-15)10-6-3-7-14-12(10)16-9-4-1-2-5-9/h3,6-7,9,11,15H,1-2,4-5,8,13H2/t11-/m1/s1.
What are the key properties of (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol?
(2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol has a molecular weight of 222.29 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-2-(2-cyclopentyloxy-3-pyridinyl)ethanol is sourced from PubChem (CID 131869094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).