(1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol

C10H16N2O — CID 124502267

IUPAC(1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol
SMILESCc1nc(N(C)C)ccc1[C@H](C)O
InChIInChI=1S/C10H16N2O/c1-7-9(8(2)13)5-6-10(11-7)12(3)4/h5-6,8,13H,1-4H3/t8-/m0/s1
InChIKeyZTERPHHAUYDNSE-QMMMGPOBSA-N
MW180.25 g/mol
LogP1.51
Rot. Bonds2

About (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol

(1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol (PubChem CID 124502267) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol
PubChem CID124502267
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name(1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol
SMILESCc1nc(N(C)C)ccc1[C@H](C)O
InChIInChI=1S/C10H16N2O/c1-7-9(8(2)13)5-6-10(11-7)12(3)4/h5-6,8,13H,1-4H3/t8-/m0/s1
InChIKeyZTERPHHAUYDNSE-QMMMGPOBSA-N
XLogP1.51
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol?
The IUPAC name of (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol (CID 124502267) is (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol.
What is the SMILES notation for (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol?
The canonical SMILES for (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol is Cc1nc(N(C)C)ccc1[C@H](C)O.
What is the InChIKey of (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol?
The InChIKey is ZTERPHHAUYDNSE-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H16N2O/c1-7-9(8(2)13)5-6-10(11-7)12(3)4/h5-6,8,13H,1-4H3/t8-/m0/s1.
What are the key properties of (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol?
(1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol has a molecular weight of 180.25 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[6-(dimethylamino)-2-methyl-3-pyridinyl]ethanol is sourced from PubChem (CID 124502267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).