5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide

C13H22N4O — CID 81317233

IUPAC5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide
SMILESCCCN(CCN(C)C)C(=O)c1ccc(N)cn1
InChIInChI=1S/C13H22N4O/c1-4-7-17(9-8-16(2)3)13(18)12-6-5-11(14)10-15-12/h5-6,10H,4,7-9,14H2,1-3H3
InChIKeyMJUNHBIOANLLEK-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.08
Rot. Bonds6

About 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide

5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide (PubChem CID 81317233) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide
PubChem CID81317233
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide
SMILESCCCN(CCN(C)C)C(=O)c1ccc(N)cn1
InChIInChI=1S/C13H22N4O/c1-4-7-17(9-8-16(2)3)13(18)12-6-5-11(14)10-15-12/h5-6,10H,4,7-9,14H2,1-3H3
InChIKeyMJUNHBIOANLLEK-UHFFFAOYSA-N
XLogP1.08
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-aminoprop-1-ynyl)-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide
CID 62953349
5-amino-N,N-bis(2-ethoxyethyl)pyridine-2-carboxamide
CID 82965848
5-(aminomethyl)-N,N-dipropylpyridine-2-carboxamide
CID 55229815
5-amino-N-butan-2-yl-N-methylpyridine-2-carboxamide
CID 81317064
N-ethyl-5-hydrazinyl-N-propylpyridine-2-carboxamide
CID 104642611
4-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide
CID 81241040
2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide
CID 62161459
5-amino-N-ethyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 81316352
6-chloro-N-[2-(dimethylamino)ethyl]-N-propylpyrazine-2-carboxamide
CID 106551556
5-N,5-N-dipropylpyridine-2,5-dicarboxamide
CID 47460392
5-amino-N-[(4-ethylphenyl)methyl]-N-methylpyridine-2-carboxamide
CID 81317186
5-cyano-N-ethyl-N-propylpyridine-2-carboxamide
CID 63717846

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide?
The IUPAC name of 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide (CID 81317233) is 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide is CCCN(CCN(C)C)C(=O)c1ccc(N)cn1.
What is the InChIKey of 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide?
The InChIKey is MJUNHBIOANLLEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-7-17(9-8-16(2)3)13(18)12-6-5-11(14)10-15-12/h5-6,10H,4,7-9,14H2,1-3H3.
What are the key properties of 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide?
5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 1.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide is sourced from PubChem (CID 81317233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).