4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide

C11H17N3O2 — CID 81074023

IUPAC4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide
SMILESCCOCCN(C)C(=O)c1cc(N)ccn1
InChIInChI=1S/C11H17N3O2/c1-3-16-7-6-14(2)11(15)10-8-9(12)4-5-13-10/h4-5,8H,3,6-7H2,1-2H3,(H2,12,13)
InChIKeyDRDPJHTYULIRPP-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.77
Rot. Bonds5

About 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide

4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide (PubChem CID 81074023) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide
PubChem CID81074023
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide
SMILESCCOCCN(C)C(=O)c1cc(N)ccn1
InChIInChI=1S/C11H17N3O2/c1-3-16-7-6-14(2)11(15)10-8-9(12)4-5-13-10/h4-5,8H,3,6-7H2,1-2H3,(H2,12,13)
InChIKeyDRDPJHTYULIRPP-UHFFFAOYSA-N
XLogP0.77
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-butyl-N-methylpyridine-2-carboxamide
CID 62153373
4-amino-N,N-dimethylpyridine-2-carboxamide;hydrochloride
CID 167725414
5-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide
CID 81053194
4-chloro-N,N-bis(2-ethoxyethyl)pyridine-2-carboxamide
CID 82965080
5-amino-N-(2-ethoxyethyl)-N-methyl-1H-indazole-3-carboxamide
CID 81053101
4-amino-N-[(4-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 55041871
2-(2-aminoethyl)-N-(2-ethoxyethyl)-N-methyl-1,3-thiazole-4-carboxamide
CID 81059550
N-(2-ethoxyethyl)-3-hydroxy-N-methylpyridine-2-carboxamide
CID 81056077
N-(2-ethoxyethyl)-6-fluoro-N-methylpyridine-2-carboxamide
CID 115498047
3-amino-N-(2-ethoxyethyl)-N,4-dimethylbenzamide
CID 81052864
4-amino-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 62154340
4-amino-N-butyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 62160207

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide (CID 81074023) is 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide is CCOCCN(C)C(=O)c1cc(N)ccn1.
What is the InChIKey of 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide?
The InChIKey is DRDPJHTYULIRPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-3-16-7-6-14(2)11(15)10-8-9(12)4-5-13-10/h4-5,8H,3,6-7H2,1-2H3,(H2,12,13).
What are the key properties of 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide?
4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-ethoxyethyl)-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 81074023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).