N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide

C20H26N4O2 — CID 109161832

IUPACN-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide
SMILESCCCN(CCC)c1ccc(C(=O)Nc2cccc(NC(C)=O)c2)cn1
InChIInChI=1S/C20H26N4O2/c1-4-11-24(12-5-2)19-10-9-16(14-21-19)20(26)23-18-8-6-7-17(13-18)22-15(3)25/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyJOOPCKBOLXTXOP-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.92
Rot. Bonds8

About N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide

N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide (PubChem CID 109161832) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide
PubChem CID109161832
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC NameN-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide
SMILESCCCN(CCC)c1ccc(C(=O)Nc2cccc(NC(C)=O)c2)cn1
InChIInChI=1S/C20H26N4O2/c1-4-11-24(12-5-2)19-10-9-16(14-21-19)20(26)23-18-8-6-7-17(13-18)22-15(3)25/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyJOOPCKBOLXTXOP-UHFFFAOYSA-N
XLogP3.92
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(dipropylamino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109161795
6-(dipropylamino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109161818
6-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 109161852
N-(3-acetylphenyl)-2-(dipropylamino)pyrimidine-5-carboxamide
CID 109264701
6-(dipropylamino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109161816
6-(dipropylamino)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109161849
N-(3-amino-4-methoxyphenyl)-6-[ethyl(propyl)amino]pyridine-3-carboxamide
CID 119419659
N-(3-chlorophenyl)-2-(dipropylamino)pyrimidine-5-carboxamide
CID 109264675
N-(3-acetamidophenyl)-6-[3-(dimethylamino)propylamino]pyridine-3-carboxamide
CID 109154328
6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109161821
6-(diethylamino)-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 48659585
N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241075

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide (CID 109161832) is N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide is CCCN(CCC)c1ccc(C(=O)Nc2cccc(NC(C)=O)c2)cn1.
What is the InChIKey of N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide?
The InChIKey is JOOPCKBOLXTXOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-4-11-24(12-5-2)19-10-9-16(14-21-19)20(26)23-18-8-6-7-17(13-18)22-15(3)25/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,22,25)(H,23,26).
What are the key properties of N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide?
N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide has a molecular weight of 354.45 g/mol, XLogP of 3.92, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-6-(dipropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109161832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).