2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide

C14H15N3O2 — CID 122569110

IUPAC2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide
SMILESCOc1ccc(-c2ncccc2C(=O)N(C)C)cn1
InChIInChI=1S/C14H15N3O2/c1-17(2)14(18)11-5-4-8-15-13(11)10-6-7-12(19-3)16-9-10/h4-9H,1-3H3
InChIKeySEXVYPRQLGQBPM-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.85
Rot. Bonds3

About 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide

2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide (PubChem CID 122569110) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide
PubChem CID122569110
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide
SMILESCOc1ccc(-c2ncccc2C(=O)N(C)C)cn1
InChIInChI=1S/C14H15N3O2/c1-17(2)14(18)11-5-4-8-15-13(11)10-6-7-12(19-3)16-9-10/h4-9H,1-3H3
InChIKeySEXVYPRQLGQBPM-UHFFFAOYSA-N
XLogP1.85
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide (CID 122569110) is 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide is COc1ccc(-c2ncccc2C(=O)N(C)C)cn1.
What is the InChIKey of 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is SEXVYPRQLGQBPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-17(2)14(18)11-5-4-8-15-13(11)10-6-7-12(19-3)16-9-10/h4-9H,1-3H3.
What are the key properties of 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide?
2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.85, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-3-pyridinyl)-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 122569110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).