2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide

C15H17N3O2 — CID 110475171

IUPAC2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
SMILESCc1cc(O)ccc1NC(=O)c1cccnc1N(C)C
InChIInChI=1S/C15H17N3O2/c1-10-9-11(19)6-7-13(10)17-15(20)12-5-4-8-16-14(12)18(2)3/h4-9,19H,1-3H3,(H,17,20)
InChIKeyRCSFEMCMANZLRR-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.41
Rot. Bonds3

About 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide

2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide (PubChem CID 110475171) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
PubChem CID110475171
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
SMILESCc1cc(O)ccc1NC(=O)c1cccnc1N(C)C
InChIInChI=1S/C15H17N3O2/c1-10-9-11(19)6-7-13(10)17-15(20)12-5-4-8-16-14(12)18(2)3/h4-9,19H,1-3H3,(H,17,20)
InChIKeyRCSFEMCMANZLRR-UHFFFAOYSA-N
XLogP2.41
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide (CID 110475171) is 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide is Cc1cc(O)ccc1NC(=O)c1cccnc1N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide?
The InChIKey is RCSFEMCMANZLRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-9-11(19)6-7-13(10)17-15(20)12-5-4-8-16-14(12)18(2)3/h4-9,19H,1-3H3,(H,17,20).
What are the key properties of 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide?
2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.41, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 110475171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).