N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide

C13H14N4O2 — CID 105068226

IUPACN-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide
SMILESCNc1cnccc1C(=O)Nc1ccc(OC)nc1
InChIInChI=1S/C13H14N4O2/c1-14-11-8-15-6-5-10(11)13(18)17-9-3-4-12(19-2)16-7-9/h3-8,14H,1-2H3,(H,17,18)
InChIKeyRPEKODUTNQIXRS-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.78
Rot. Bonds4

About N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide

N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide (PubChem CID 105068226) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide
PubChem CID105068226
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC NameN-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide
SMILESCNc1cnccc1C(=O)Nc1ccc(OC)nc1
InChIInChI=1S/C13H14N4O2/c1-14-11-8-15-6-5-10(11)13(18)17-9-3-4-12(19-2)16-7-9/h3-8,14H,1-2H3,(H,17,18)
InChIKeyRPEKODUTNQIXRS-UHFFFAOYSA-N
XLogP1.78
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide (CID 105068226) is N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide is CNc1cnccc1C(=O)Nc1ccc(OC)nc1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide?
The InChIKey is RPEKODUTNQIXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-14-11-8-15-6-5-10(11)13(18)17-9-3-4-12(19-2)16-7-9/h3-8,14H,1-2H3,(H,17,18).
What are the key properties of N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide?
N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.78, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-3-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105068226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).