[6-(benzylamino)-2-methyl-3-pyridinyl]methanol

C14H16N2O — CID 102546130

IUPAC[6-(benzylamino)-2-methyl-3-pyridinyl]methanol
SMILESCc1nc(NCc2ccccc2)ccc1CO
InChIInChI=1S/C14H16N2O/c1-11-13(10-17)7-8-14(16-11)15-9-12-5-3-2-4-6-12/h2-8,17H,9-10H2,1H3,(H,15,16)
InChIKeyOOIZXMWZNWPISB-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.49
Rot. Bonds4

About [6-(benzylamino)-2-methyl-3-pyridinyl]methanol

[6-(benzylamino)-2-methyl-3-pyridinyl]methanol (PubChem CID 102546130) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is [6-(benzylamino)-2-methyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(benzylamino)-2-methyl-3-pyridinyl]methanol
PubChem CID102546130
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name[6-(benzylamino)-2-methyl-3-pyridinyl]methanol
SMILESCc1nc(NCc2ccccc2)ccc1CO
InChIInChI=1S/C14H16N2O/c1-11-13(10-17)7-8-14(16-11)15-9-12-5-3-2-4-6-12/h2-8,17H,9-10H2,1H3,(H,15,16)
InChIKeyOOIZXMWZNWPISB-UHFFFAOYSA-N
XLogP2.49
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(benzylamino)-2-methyl-3-pyridinyl]methanol?
The IUPAC name of [6-(benzylamino)-2-methyl-3-pyridinyl]methanol (CID 102546130) is [6-(benzylamino)-2-methyl-3-pyridinyl]methanol.
What is the SMILES notation for [6-(benzylamino)-2-methyl-3-pyridinyl]methanol?
The canonical SMILES for [6-(benzylamino)-2-methyl-3-pyridinyl]methanol is Cc1nc(NCc2ccccc2)ccc1CO.
What is the InChIKey of [6-(benzylamino)-2-methyl-3-pyridinyl]methanol?
The InChIKey is OOIZXMWZNWPISB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-11-13(10-17)7-8-14(16-11)15-9-12-5-3-2-4-6-12/h2-8,17H,9-10H2,1H3,(H,15,16).
What are the key properties of [6-(benzylamino)-2-methyl-3-pyridinyl]methanol?
[6-(benzylamino)-2-methyl-3-pyridinyl]methanol has a molecular weight of 228.30 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(benzylamino)-2-methyl-3-pyridinyl]methanol is sourced from PubChem (CID 102546130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).