[4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol

C15H18N2O — CID 81238710

IUPAC[4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol
SMILESCCN(c1ccccc1C)c1ccncc1CO
InChIInChI=1S/C15H18N2O/c1-3-17(14-7-5-4-6-12(14)2)15-8-9-16-10-13(15)11-18/h4-10,18H,3,11H2,1-2H3
InChIKeySUKVYAJAQPCRGF-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.04
Rot. Bonds4

About [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol

[4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol (PubChem CID 81238710) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol
PubChem CID81238710
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol
SMILESCCN(c1ccccc1C)c1ccncc1CO
InChIInChI=1S/C15H18N2O/c1-3-17(14-7-5-4-6-12(14)2)15-8-9-16-10-13(15)11-18/h4-10,18H,3,11H2,1-2H3
InChIKeySUKVYAJAQPCRGF-UHFFFAOYSA-N
XLogP3.04
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol?
The IUPAC name of [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol (CID 81238710) is [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol.
What is the SMILES notation for [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol?
The canonical SMILES for [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol is CCN(c1ccccc1C)c1ccncc1CO.
What is the InChIKey of [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol?
The InChIKey is SUKVYAJAQPCRGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-3-17(14-7-5-4-6-12(14)2)15-8-9-16-10-13(15)11-18/h4-10,18H,3,11H2,1-2H3.
What are the key properties of [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol?
[4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol has a molecular weight of 242.32 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(N-ethyl-2-methylanilino)-3-pyridinyl]methanol is sourced from PubChem (CID 81238710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).