N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide

C15H25N3O2 — CID 115498461

IUPACN-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide
SMILESCCOCCN(CC)C(=O)c1cccc(NC(C)C)n1
InChIInChI=1S/C15H25N3O2/c1-5-18(10-11-20-6-2)15(19)13-8-7-9-14(17-13)16-12(3)4/h7-9,12H,5-6,10-11H2,1-4H3,(H,16,17)
InChIKeyWLKOFTYNHSUJPN-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.40
Rot. Bonds8

About N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide

N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide (PubChem CID 115498461) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide
PubChem CID115498461
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide
SMILESCCOCCN(CC)C(=O)c1cccc(NC(C)C)n1
InChIInChI=1S/C15H25N3O2/c1-5-18(10-11-20-6-2)15(19)13-8-7-9-14(17-13)16-12(3)4/h7-9,12H,5-6,10-11H2,1-4H3,(H,16,17)
InChIKeyWLKOFTYNHSUJPN-UHFFFAOYSA-N
XLogP2.40
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.40
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

N-ethyl-N-(2-methylbutyl)-6-(propan-2-ylamino)pyridine-2-carboxamide
CID 115498522
N,N-bis(2-ethoxyethyl)-6-(methylamino)pyridine-2-carboxamide
CID 82941671
6-amino-N-(2-ethoxyethyl)-N-ethylpyridine-2-carboxamide
CID 63691666
N-ethyl-N-(1-methoxypropan-2-yl)-6-(propan-2-ylamino)pyridine-2-carboxamide
CID 115498270
N-(2-ethoxyethyl)-N-ethyl-6-pyrazol-1-ylpyridine-2-carboxamide
CID 71930465
propyl 6-(propan-2-ylamino)pyridine-2-carboxylate
CID 115498670
N-(2-ethoxyethyl)-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
CID 63691498
N-methyl-N-(3-methylbutyl)-6-(propan-2-ylamino)pyridine-2-carboxamide
CID 115498349
N-ethyl-6-hydrazinyl-N-propylpyridine-2-carboxamide
CID 62243182
N-ethyl-6-hydrazinyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 62237151
N-(2-ethoxyethyl)-N-ethylbenzamide
CID 63718241
6-(1-ethoxypropan-2-ylamino)pyridine-2-carboxylic acid
CID 62240918

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide?
The IUPAC name of N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide (CID 115498461) is N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide is CCOCCN(CC)C(=O)c1cccc(NC(C)C)n1.
What is the InChIKey of N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide?
The InChIKey is WLKOFTYNHSUJPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-5-18(10-11-20-6-2)15(19)13-8-7-9-14(17-13)16-12(3)4/h7-9,12H,5-6,10-11H2,1-4H3,(H,16,17).
What are the key properties of N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide?
N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 2.40, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N-ethyl-6-(propan-2-ylamino)pyridine-2-carboxamide is sourced from PubChem (CID 115498461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).