(S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol

C19H17NO2 — CID 124501783

IUPAC(S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol
SMILESCc1cc(Oc2ccccc2)ncc1[C@@H](O)c1ccccc1
InChIInChI=1S/C19H17NO2/c1-14-12-18(22-16-10-6-3-7-11-16)20-13-17(14)19(21)15-8-4-2-5-9-15/h2-13,19,21H,1H3/t19-/m0/s1
InChIKeySJJSTNIFPVNOGX-IBGZPJMESA-N
MW291.35 g/mol
LogP4.26
Rot. Bonds4

About (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol

(S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol (PubChem CID 124501783) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol.

Molecular Properties

Compound Name(S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol
PubChem CID124501783
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name(S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol
SMILESCc1cc(Oc2ccccc2)ncc1[C@@H](O)c1ccccc1
InChIInChI=1S/C19H17NO2/c1-14-12-18(22-16-10-6-3-7-11-16)20-13-17(14)19(21)15-8-4-2-5-9-15/h2-13,19,21H,1H3/t19-/m0/s1
InChIKeySJJSTNIFPVNOGX-IBGZPJMESA-N
XLogP4.26
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(R)-(6-tert-butylsulfanyl-4-methyl-3-pyridinyl)-phenylmethanol
CID 124502131
(S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol
CID 124501757
[4-methyl-6-(methylamino)-3-pyridinyl]-phenylmethanol
CID 102545191
[4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol
CID 102545154
1-(5-methyl-6-phenoxy-3-pyridinyl)ethanol
CID 102544608
(1S)-1-(5-methyl-6-phenoxy-3-pyridinyl)ethanol
CID 124501265
(4-methoxy-2-methylphenyl)-phenylmethanol
CID 61101114
(S)-[6-[ethyl(methyl)amino]-4-methyl-3-pyridinyl]-phenylmethanol
CID 124501822
(S)-[4-methyl-6-(propylamino)-3-pyridinyl]-phenylmethanol
CID 124501809
[4-methyl-6-(propylamino)-3-pyridinyl]-phenylmethanol
CID 102545295
1-(4-methyl-6-phenylmethoxy-3-pyridinyl)ethanol
CID 102545457
N-methyl-1-(4-methyl-6-phenoxy-3-pyridinyl)methanamine
CID 102545259

Frequently Asked Questions

What is the IUPAC name of (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol?
The IUPAC name of (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol (CID 124501783) is (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol.
What is the SMILES notation for (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol?
The canonical SMILES for (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol is Cc1cc(Oc2ccccc2)ncc1[C@@H](O)c1ccccc1.
What is the InChIKey of (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol?
The InChIKey is SJJSTNIFPVNOGX-IBGZPJMESA-N. The full InChI is InChI=1S/C19H17NO2/c1-14-12-18(22-16-10-6-3-7-11-16)20-13-17(14)19(21)15-8-4-2-5-9-15/h2-13,19,21H,1H3/t19-/m0/s1.
What are the key properties of (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol?
(S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol has a molecular weight of 291.35 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol is sourced from PubChem (CID 124501783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).