6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide

C13H22N4O — CID 62238759

IUPAC6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
SMILESCCN(CC)CCCNC(=O)c1cccc(N)n1
InChIInChI=1S/C13H22N4O/c1-3-17(4-2)10-6-9-15-13(18)11-7-5-8-12(14)16-11/h5,7-8H,3-4,6,9-10H2,1-2H3,(H2,14,16)(H,15,18)
InChIKeyUFCWCFAYOATNBY-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.13
Rot. Bonds7

About 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide

6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide (PubChem CID 62238759) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
PubChem CID62238759
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
SMILESCCN(CC)CCCNC(=O)c1cccc(N)n1
InChIInChI=1S/C13H22N4O/c1-3-17(4-2)10-6-9-15-13(18)11-7-5-8-12(14)16-11/h5,7-8H,3-4,6,9-10H2,1-2H3,(H2,14,16)(H,15,18)
InChIKeyUFCWCFAYOATNBY-UHFFFAOYSA-N
XLogP1.13
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.13
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

6-amino-N-[2-[ethyl(methyl)amino]ethyl]pyridine-2-carboxamide
CID 62641667
6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 62238827
6-amino-N-[2-[cyclopropyl(ethyl)amino]ethyl]pyridine-2-carboxamide
CID 113304896
6-amino-N-(5-methylsulfanylpentyl)pyridine-2-carboxamide
CID 114129261
N-[2-(diethylamino)ethyl]-6-fluoropyridine-2-carboxamide
CID 115496571
6-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 62240593
2-amino-N-[3-(diethylamino)propyl]-1,3-thiazole-4-carboxamide
CID 55116109
1-N,4-N-bis[3-(diethylamino)propyl]benzene-1,4-dicarboxamide
CID 2842708
6-amino-N-[2-(ethylamino)-2-oxoethyl]pyridine-2-carboxamide
CID 62238608
6-amino-N-[2-(methylsulfamoyl)ethyl]pyridine-2-carboxamide
CID 106342484
3-amino-N-[3-(diethylamino)propyl]-1H-pyrazole-5-carboxamide
CID 64524402
N-[3-(diethylamino)propyl]-2,6-dimethoxybenzamide
CID 3301412

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide?
The IUPAC name of 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide (CID 62238759) is 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide?
The canonical SMILES for 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide is CCN(CC)CCCNC(=O)c1cccc(N)n1.
What is the InChIKey of 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide?
The InChIKey is UFCWCFAYOATNBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-3-17(4-2)10-6-9-15-13(18)11-7-5-8-12(14)16-11/h5,7-8H,3-4,6,9-10H2,1-2H3,(H2,14,16)(H,15,18).
What are the key properties of 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide?
6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 1.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide is sourced from PubChem (CID 62238759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).