[6-(diethylamino)-3-pyridinyl]-phenylmethanol

C16H20N2O — CID 102546636

IUPAC[6-(diethylamino)-3-pyridinyl]-phenylmethanol
SMILESCCN(CC)c1ccc(C(O)c2ccccc2)cn1
InChIInChI=1S/C16H20N2O/c1-3-18(4-2)15-11-10-14(12-17-15)16(19)13-8-6-5-7-9-13/h5-12,16,19H,3-4H2,1-2H3
InChIKeyPTEISPUPYZXADY-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.01
Rot. Bonds5

About [6-(diethylamino)-3-pyridinyl]-phenylmethanol

[6-(diethylamino)-3-pyridinyl]-phenylmethanol (PubChem CID 102546636) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is [6-(diethylamino)-3-pyridinyl]-phenylmethanol.

Molecular Properties

Compound Name[6-(diethylamino)-3-pyridinyl]-phenylmethanol
PubChem CID102546636
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name[6-(diethylamino)-3-pyridinyl]-phenylmethanol
SMILESCCN(CC)c1ccc(C(O)c2ccccc2)cn1
InChIInChI=1S/C16H20N2O/c1-3-18(4-2)15-11-10-14(12-17-15)16(19)13-8-6-5-7-9-13/h5-12,16,19H,3-4H2,1-2H3
InChIKeyPTEISPUPYZXADY-UHFFFAOYSA-N
XLogP3.01
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(diethylamino)-3-pyridinyl]-phenylmethanol?
The IUPAC name of [6-(diethylamino)-3-pyridinyl]-phenylmethanol (CID 102546636) is [6-(diethylamino)-3-pyridinyl]-phenylmethanol.
What is the SMILES notation for [6-(diethylamino)-3-pyridinyl]-phenylmethanol?
The canonical SMILES for [6-(diethylamino)-3-pyridinyl]-phenylmethanol is CCN(CC)c1ccc(C(O)c2ccccc2)cn1.
What is the InChIKey of [6-(diethylamino)-3-pyridinyl]-phenylmethanol?
The InChIKey is PTEISPUPYZXADY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-3-18(4-2)15-11-10-14(12-17-15)16(19)13-8-6-5-7-9-13/h5-12,16,19H,3-4H2,1-2H3.
What are the key properties of [6-(diethylamino)-3-pyridinyl]-phenylmethanol?
[6-(diethylamino)-3-pyridinyl]-phenylmethanol has a molecular weight of 256.35 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(diethylamino)-3-pyridinyl]-phenylmethanol is sourced from PubChem (CID 102546636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).