6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide

C13H21N3O2 — CID 63009314

IUPAC6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)N(C)CCCOC)cn1
InChIInChI=1S/C13H21N3O2/c1-4-14-12-7-6-11(10-15-12)13(17)16(2)8-5-9-18-3/h6-7,10H,4-5,8-9H2,1-3H3,(H,14,15)
InChIKeyWYSCKLGYWQBMKP-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.62
Rot. Bonds7

About 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide

6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide (PubChem CID 63009314) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide
PubChem CID63009314
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)N(C)CCCOC)cn1
InChIInChI=1S/C13H21N3O2/c1-4-14-12-7-6-11(10-15-12)13(17)16(2)8-5-9-18-3/h6-7,10H,4-5,8-9H2,1-3H3,(H,14,15)
InChIKeyWYSCKLGYWQBMKP-UHFFFAOYSA-N
XLogP1.62
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.62
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-[3-(dimethylamino)propyl]-6-(ethylamino)-N-methylpyridine-3-carboxamide
CID 55226022
6-(ethylamino)-N-methyl-N-propylpyridine-3-carboxamide
CID 62167941
N-butyl-6-[3-(dimethylamino)propylamino]-N-methylpyridine-3-carboxamide
CID 109154268
6-(ethylamino)-N-(2-hydroxypropyl)-N-methylpyridine-3-carboxamide
CID 62337035
N-butyl-6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
CID 109158989
N-[3-(dimethylamino)propyl]-N-ethyl-6-(ethylamino)pyridine-3-carboxamide
CID 102996750
N-(cyclopropylmethyl)-6-(ethylamino)-N-methylpyridine-3-carboxamide
CID 62180065
N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide
CID 55046985
N-butyl-2-(3-methoxypropylamino)-N-methylpyrimidine-5-carboxamide
CID 109251916
N-butyl-6-[2-(2-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
CID 109158752
6-(ethylamino)-N-methyl-N-pentan-3-ylpyridine-3-carboxamide
CID 55046782
N-[3-(diethylamino)propyl]-6-(ethylamino)pyridine-3-carboxamide
CID 62165858

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide (CID 63009314) is 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide is CCNc1ccc(C(=O)N(C)CCCOC)cn1.
What is the InChIKey of 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide?
The InChIKey is WYSCKLGYWQBMKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-4-14-12-7-6-11(10-15-12)13(17)16(2)8-5-9-18-3/h6-7,10H,4-5,8-9H2,1-3H3,(H,14,15).
What are the key properties of 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide?
6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide has a molecular weight of 251.33 g/mol, XLogP of 1.62, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(3-methoxypropyl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 63009314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).