4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide

C20H26N4O2 — CID 102532472

IUPAC4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide
SMILESCN(C)c1ccc(C(=O)Nc2cccc(NC(=O)CC(C)(C)C)n2)cc1
InChIInChI=1S/C20H26N4O2/c1-20(2,3)13-18(25)22-16-7-6-8-17(21-16)23-19(26)14-9-11-15(12-10-14)24(4)5/h6-12H,13H2,1-5H3,(H2,21,22,23,25,26)
InChIKeyHVLCSVCSBAXMNV-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.77
Rot. Bonds5

About 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide

4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide (PubChem CID 102532472) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide
PubChem CID102532472
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC Name4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide
SMILESCN(C)c1ccc(C(=O)Nc2cccc(NC(=O)CC(C)(C)C)n2)cc1
InChIInChI=1S/C20H26N4O2/c1-20(2,3)13-18(25)22-16-7-6-8-17(21-16)23-19(26)14-9-11-15(12-10-14)24(4)5/h6-12H,13H2,1-5H3,(H2,21,22,23,25,26)
InChIKeyHVLCSVCSBAXMNV-UHFFFAOYSA-N
XLogP3.77
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]-4-methylbenzamide
CID 102532473
N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide
CID 102532470
N-(6-chloro-2-pyridinyl)-3,3-dimethylbutanamide
CID 115669489
N-(6-fluoro-2-pyridinyl)-3,3-dimethylbutanamide
CID 104820780
4-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 47423237
4-tert-butyl-N-[2-[[4-(dimethylamino)benzoyl]amino]ethyl]benzamide
CID 108542009
4-(dimethylamino)-N-[2-(hydroxymethyl)phenyl]benzamide
CID 60653502
4-ethoxy-N-[6-[(4-ethoxybenzoyl)amino]-2-pyridinyl]benzamide
CID 4204904
N-[6-(dimethylamino)-2-pyridinyl]-3,3,3-trifluoropropanamide
CID 75519408
4-N-tert-butyl-1-N-[4-(dimethylamino)phenyl]benzene-1,4-dicarboxamide
CID 109048526
N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-4-ethenylbenzamide
CID 102139348
4-(dimethylamino)-N-(3-hydroxyphenyl)benzamide
CID 28739881

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide?
The IUPAC name of 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide (CID 102532472) is 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide?
The canonical SMILES for 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide is CN(C)c1ccc(C(=O)Nc2cccc(NC(=O)CC(C)(C)C)n2)cc1.
What is the InChIKey of 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide?
The InChIKey is HVLCSVCSBAXMNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-20(2,3)13-18(25)22-16-7-6-8-17(21-16)23-19(26)14-9-11-15(12-10-14)24(4)5/h6-12H,13H2,1-5H3,(H2,21,22,23,25,26).
What are the key properties of 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide?
4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide has a molecular weight of 354.45 g/mol, XLogP of 3.77, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-[6-(3,3-dimethylbutanoylamino)-2-pyridinyl]benzamide is sourced from PubChem (CID 102532472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).