N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide

C20H26N4O2 — CID 109241075

IUPACN-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide
SMILESCCCN(CCC)c1cncc(C(=O)Nc2ccc(NC(C)=O)cc2)c1
InChIInChI=1S/C20H26N4O2/c1-4-10-24(11-5-2)19-12-16(13-21-14-19)20(26)23-18-8-6-17(7-9-18)22-15(3)25/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyVMYKNPBDSAESLF-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.92
Rot. Bonds8

About N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide

N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide (PubChem CID 109241075) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide
PubChem CID109241075
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC NameN-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide
SMILESCCCN(CCC)c1cncc(C(=O)Nc2ccc(NC(C)=O)cc2)c1
InChIInChI=1S/C20H26N4O2/c1-4-10-24(11-5-2)19-12-16(13-21-14-19)20(26)23-18-8-6-17(7-9-18)22-15(3)25/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyVMYKNPBDSAESLF-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

N-[4-(dimethylamino)phenyl]-5-(dipropylamino)pyridine-3-carboxamide
CID 109241081
5-(dipropylamino)-N-phenylpyridine-3-carboxamide
CID 109241022
N-(3-bromo-4-methylphenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241057
5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 109241100
N-(2-bromophenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241090
N-(2-bromo-4-methylphenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241092
5-(4-acetamidoanilino)-N-[4-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 109245894
ethyl 4-[[5-(diethylamino)pyridine-3-carbonyl]amino]benzoate
CID 109238980
5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide
CID 109240365
5-[benzyl(ethyl)amino]-N-phenylpyridine-3-carboxamide
CID 109234844
5-N-(4-acetamidophenyl)-3-N-[3-(dimethylamino)propyl]pyridine-3,5-dicarboxamide
CID 109104366
N-cyclohexyl-5-(dipropylamino)pyridine-3-carboxamide
CID 109226706

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide (CID 109241075) is N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide is CCCN(CCC)c1cncc(C(=O)Nc2ccc(NC(C)=O)cc2)c1.
What is the InChIKey of N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide?
The InChIKey is VMYKNPBDSAESLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-4-10-24(11-5-2)19-12-16(13-21-14-19)20(26)23-18-8-6-17(7-9-18)22-15(3)25/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,22,25)(H,23,26).
What are the key properties of N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide?
N-(4-acetamidophenyl)-5-(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-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109241075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).