(S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol

C15H18N2O — CID 124501757

IUPAC(S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol
SMILESCc1cc(N(C)C)ncc1[C@@H](O)c1ccccc1
InChIInChI=1S/C15H18N2O/c1-11-9-14(17(2)3)16-10-13(11)15(18)12-7-5-4-6-8-12/h4-10,15,18H,1-3H3/t15-/m0/s1
InChIKeyZBRHQZCCNRWTJN-HNNXBMFYSA-N
MW242.32 g/mol
LogP2.54
Rot. Bonds3

About (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol

(S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol (PubChem CID 124501757) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol.

Molecular Properties

Compound Name(S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol
PubChem CID124501757
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name(S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol
SMILESCc1cc(N(C)C)ncc1[C@@H](O)c1ccccc1
InChIInChI=1S/C15H18N2O/c1-11-9-14(17(2)3)16-10-13(11)15(18)12-7-5-4-6-8-12/h4-10,15,18H,1-3H3/t15-/m0/s1
InChIKeyZBRHQZCCNRWTJN-HNNXBMFYSA-N
XLogP2.54
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(S)-[6-[ethyl(methyl)amino]-4-methyl-3-pyridinyl]-phenylmethanol
CID 124501822
[4-methyl-6-(methylamino)-3-pyridinyl]-phenylmethanol
CID 102545191
[4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol
CID 102545154
(S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol
CID 124501783
(R)-(6-tert-butylsulfanyl-4-methyl-3-pyridinyl)-phenylmethanol
CID 124502131
(S)-[4-methyl-6-(propylamino)-3-pyridinyl]-phenylmethanol
CID 124501809
[4-methyl-6-(propylamino)-3-pyridinyl]-phenylmethanol
CID 102545295
(2,4-dimethylphenyl)-phenylmethanol
CID 3807153
[4-(dimethylamino)-2-phenylpyrimidin-5-yl]-phenylmethanol
CID 59517634
(S)-[6-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-3-pyridinyl]-phenylmethanol
CID 124502145
[2-methyl-4-(trifluoromethyl)phenyl]-phenylmethanol
CID 102751287
(4-methoxy-2-methylphenyl)-phenylmethanol
CID 61101114

Frequently Asked Questions

What is the IUPAC name of (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol?
The IUPAC name of (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol (CID 124501757) is (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol.
What is the SMILES notation for (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol?
The canonical SMILES for (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol is Cc1cc(N(C)C)ncc1[C@@H](O)c1ccccc1.
What is the InChIKey of (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol?
The InChIKey is ZBRHQZCCNRWTJN-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-9-14(17(2)3)16-10-13(11)15(18)12-7-5-4-6-8-12/h4-10,15,18H,1-3H3/t15-/m0/s1.
What are the key properties of (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol?
(S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol has a molecular weight of 242.32 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol is sourced from PubChem (CID 124501757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).