N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide

C12H19N3O — CID 62172696

IUPACN,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(CC)CC)ccn1
InChIInChI=1S/C12H19N3O/c1-4-13-11-9-10(7-8-14-11)12(16)15(5-2)6-3/h7-9H,4-6H2,1-3H3,(H,13,14)
InChIKeyDQBJJMWMEJUOIH-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.00
Rot. Bonds5

About N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide

N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide (PubChem CID 62172696) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
PubChem CID62172696
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(CC)CC)ccn1
InChIInChI=1S/C12H19N3O/c1-4-13-11-9-10(7-8-14-11)12(16)15(5-2)6-3/h7-9H,4-6H2,1-3H3,(H,13,14)
InChIKeyDQBJJMWMEJUOIH-UHFFFAOYSA-N
XLogP2.00
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 55042857
N-ethyl-2-(ethylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 62181870
2-(ethylamino)-N,N-dipropylpyridine-4-carboxamide
CID 62167745
N,N-diethyl-2-[2-(4-methoxyphenoxy)ethylamino]pyridine-4-carboxamide
CID 109174710
2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide
CID 109174721
2-(ethylamino)-N-(3-hydroxybutyl)-N-methylpyridine-4-carboxamide
CID 115704020
N-benzyl-N-ethyl-2-(propylamino)pyridine-4-carboxamide
CID 109165092
N-ethyl-N-methyl-2-(methylamino)pyridine-4-carboxamide
CID 62170484
N-[2-(dimethylcarbamoylamino)ethyl]-2-(ethylamino)pyridine-4-carboxamide
CID 83115069
N-[2-(dimethylamino)-2-methylpropyl]-2-(ethylamino)pyridine-4-carboxamide
CID 62177284
2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 62175582
2-(ethylamino)-N-methyl-N-(4-methylsulfanylbutan-2-yl)pyridine-4-carboxamide
CID 115683356

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide?
The IUPAC name of N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide (CID 62172696) is N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide.
What is the SMILES notation for N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide?
The canonical SMILES for N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide is CCNc1cc(C(=O)N(CC)CC)ccn1.
What is the InChIKey of N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide?
The InChIKey is DQBJJMWMEJUOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-13-11-9-10(7-8-14-11)12(16)15(5-2)6-3/h7-9H,4-6H2,1-3H3,(H,13,14).
What are the key properties of N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide?
N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 62172696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).