2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide

C13H22N4O — CID 62161459

IUPAC2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide
SMILESCCCN(CCN(C)C)C(=O)c1cccnc1N
InChIInChI=1S/C13H22N4O/c1-4-8-17(10-9-16(2)3)13(18)11-6-5-7-15-12(11)14/h5-7H,4,8-10H2,1-3H3,(H2,14,15)
InChIKeyFNUGNEWZLXNFLE-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.08
Rot. Bonds6

About 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide

2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide (PubChem CID 62161459) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide
PubChem CID62161459
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide
SMILESCCCN(CCN(C)C)C(=O)c1cccnc1N
InChIInChI=1S/C13H22N4O/c1-4-8-17(10-9-16(2)3)13(18)11-6-5-7-15-12(11)14/h5-7H,4,8-10H2,1-3H3,(H2,14,15)
InChIKeyFNUGNEWZLXNFLE-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

2-[2-(dimethylamino)ethyl-propylcarbamoyl]pyridine-3-carboxylic acid
CID 63614113
2-amino-N-(2-cyanoethyl)-N-ethylpyridine-3-carboxamide
CID 62161601
2-amino-3-chloro-N-[2-(dimethylamino)ethyl]-N-propylbenzamide
CID 115540587
4-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide
CID 81241040
2-ethoxy-N,N-dipropylpyridine-3-carboxamide
CID 78836443
N-ethyl-2-hydrazinyl-N-propylpyridine-3-carboxamide
CID 62242635
2-amino-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-carboxamide
CID 63961873
2-amino-N-(2-cyanopropyl)-N-ethylpyridine-3-carboxamide
CID 62186486
2-amino-N,N-bis(cyanomethyl)pyridine-3-carboxamide
CID 62152670
2-amino-N,N-dipropylbenzamide
CID 16769117
2-amino-N-methyl-N-(3-methylbutyl)pyridine-3-carboxamide
CID 62185668
5-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide
CID 81317233

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide?
The IUPAC name of 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide (CID 62161459) is 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide is CCCN(CCN(C)C)C(=O)c1cccnc1N.
What is the InChIKey of 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide?
The InChIKey is FNUGNEWZLXNFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-8-17(10-9-16(2)3)13(18)11-6-5-7-15-12(11)14/h5-7H,4,8-10H2,1-3H3,(H2,14,15).
What are the key properties of 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide?
2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-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 2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 62161459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).