2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide

C15H17N3O2 — CID 158427957

IUPAC2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide
SMILESCOc1ncc(-c2ncccc2C)cc1C(=O)N(C)C
InChIInChI=1S/C15H17N3O2/c1-10-6-5-7-16-13(10)11-8-12(15(19)18(2)3)14(20-4)17-9-11/h5-9H,1-4H3
InChIKeyHBHDMIDPSYPAAR-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.16
Rot. Bonds3

About 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide

2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide (PubChem CID 158427957) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide
PubChem CID158427957
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide
SMILESCOc1ncc(-c2ncccc2C)cc1C(=O)N(C)C
InChIInChI=1S/C15H17N3O2/c1-10-6-5-7-16-13(10)11-8-12(15(19)18(2)3)14(20-4)17-9-11/h5-9H,1-4H3
InChIKeyHBHDMIDPSYPAAR-UHFFFAOYSA-N
XLogP2.16
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide (CID 158427957) is 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide is COc1ncc(-c2ncccc2C)cc1C(=O)N(C)C.
What is the InChIKey of 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide?
The InChIKey is HBHDMIDPSYPAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-6-5-7-16-13(10)11-8-12(15(19)18(2)3)14(20-4)17-9-11/h5-9H,1-4H3.
What are the key properties of 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide?
2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.16, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,N-dimethyl-5-(3-methyl-2-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 158427957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).