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

C12H20N4O — CID 104740794

IUPAC3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide
SMILESCCN(CC)CCNC(=O)c1ncccc1N
InChIInChI=1S/C12H20N4O/c1-3-16(4-2)9-8-15-12(17)11-10(13)6-5-7-14-11/h5-7H,3-4,8-9,13H2,1-2H3,(H,15,17)
InChIKeyLXEYULBDURSCOX-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.74
Rot. Bonds6

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

3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide (PubChem CID 104740794) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide
PubChem CID104740794
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide
SMILESCCN(CC)CCNC(=O)c1ncccc1N
InChIInChI=1S/C12H20N4O/c1-3-16(4-2)9-8-15-12(17)11-10(13)6-5-7-14-11/h5-7H,3-4,8-9,13H2,1-2H3,(H,15,17)
InChIKeyLXEYULBDURSCOX-UHFFFAOYSA-N
XLogP0.74
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide
CID 107517764
3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 104740778
3-amino-N-ethyl-N-propylpyridine-2-carboxamide
CID 104741010
3-amino-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 104740997
3-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 104741450
3-amino-N-(2-pyrrol-1-ylethyl)pyridine-2-carboxamide
CID 114182681
3-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 104742127
3-amino-N-[2-(methanesulfonamido)ethyl]pyridine-2-carboxamide
CID 104741062
4-amino-N-[2-(diethylamino)ethyl]-1-ethylpyrazole-3-carboxamide
CID 65358786
ethyl 4-[(3-aminopyridine-2-carbonyl)amino]butanoate
CID 104742417
N-[2-(diethylamino)ethyl]-2-methoxypyridine-3-carboxamide
CID 15462606
3-amino-N-(2-sulfamoylethyl)pyridine-2-carboxamide
CID 104741064

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide (CID 104740794) is 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide is CCN(CC)CCNC(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide?
The InChIKey is LXEYULBDURSCOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-3-16(4-2)9-8-15-12(17)11-10(13)6-5-7-14-11/h5-7H,3-4,8-9,13H2,1-2H3,(H,15,17).
What are the key properties of 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide?
3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 0.74, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 104740794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).