3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide

C10H15N3O2 — CID 105064057

IUPAC3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide
SMILESCNCCNC(=O)c1ccncc1OC
InChIInChI=1S/C10H15N3O2/c1-11-5-6-13-10(14)8-3-4-12-7-9(8)15-2/h3-4,7,11H,5-6H2,1-2H3,(H,13,14)
InChIKeyCMKYEGGFLJKFOG-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.04
Rot. Bonds5

About 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide

3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide (PubChem CID 105064057) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide
PubChem CID105064057
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide
SMILESCNCCNC(=O)c1ccncc1OC
InChIInChI=1S/C10H15N3O2/c1-11-5-6-13-10(14)8-3-4-12-7-9(8)15-2/h3-4,7,11H,5-6H2,1-2H3,(H,13,14)
InChIKeyCMKYEGGFLJKFOG-UHFFFAOYSA-N
XLogP0.04
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-hydroxybutyl)-3-methoxypyridine-4-carboxamide
CID 106843109
N-(3-bromobutyl)-3-methoxypyridine-4-carboxamide
CID 105064561
3-methoxy-N-(2-methylpropyl)pyridine-4-carboxamide
CID 105063807
N-(3-amino-4-methoxybutyl)-3-methoxypyridine-4-carboxamide
CID 106243160
N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide
CID 105063699
N-(2-bromo-3-methylbutyl)-3-methoxypyridine-4-carboxamide
CID 105064608
3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
CID 105063330
3-methoxy-N-(2-pyrrolidin-2-ylethyl)pyridine-4-carboxamide
CID 105064206
N-(1H-imidazol-2-ylmethyl)-3-methoxypyridine-4-carboxamide
CID 105063994
N-[[1-(hydroxymethyl)cyclopentyl]methyl]-3-methoxypyridine-4-carboxamide
CID 105063923
N-(2-hydroxy-2,4-dimethylpentyl)-3-methoxypyridine-4-carboxamide
CID 105063908
N-(1-chloropropan-2-yl)-3-methoxypyridine-4-carboxamide
CID 105064527

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide?
The IUPAC name of 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide (CID 105064057) is 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide is CNCCNC(=O)c1ccncc1OC.
What is the InChIKey of 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide?
The InChIKey is CMKYEGGFLJKFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-11-5-6-13-10(14)8-3-4-12-7-9(8)15-2/h3-4,7,11H,5-6H2,1-2H3,(H,13,14).
What are the key properties of 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide?
3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide has a molecular weight of 209.25 g/mol, XLogP of 0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 105064057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).