3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide

C25H26N4O3 — CID 3968568

IUPAC3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide
SMILESCC(C)(CC(=O)NNC(=O)c1cccnc1)CC(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N4O3/c1-25(2,16-22(30)27-28-24(32)19-10-9-15-26-18-19)17-23(31)29(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-15,18H,16-17H2,1-2H3,(H,27,30)(H,28,32)
InChIKeyOPQJWOIXMNENSS-UHFFFAOYSA-N
MW430.51 g/mol
LogP4.01
Rot. Bonds7

About 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide

3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide (PubChem CID 3968568) has the molecular formula C25H26N4O3 and a molecular weight of 430.51 g/mol. Its IUPAC name is 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide.

Molecular Properties

Compound Name3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide
PubChem CID3968568
Molecular FormulaC25H26N4O3
Molecular Weight430.51 g/mol
Exact Mass430.20
IUPAC Name3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide
SMILESCC(C)(CC(=O)NNC(=O)c1cccnc1)CC(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N4O3/c1-25(2,16-22(30)27-28-24(32)19-10-9-15-26-18-19)17-23(31)29(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-15,18H,16-17H2,1-2H3,(H,27,30)(H,28,32)
InChIKeyOPQJWOIXMNENSS-UHFFFAOYSA-N
XLogP4.01
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.51
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3,3-dimethyl-5-oxo-N-(4-phenylmethoxyphenyl)-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide
CID 3888053
N-(2,3-dichlorophenyl)-3,3-dimethyl-5-oxo-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide
CID 4236223
N'-(4-oxo-4-phenylbutanoyl)pyridine-3-carbohydrazide
CID 35152458
N'-dodecanoylpyridine-3-carbohydrazide
CID 171977470
N'-decanoylpyridine-3-carbohydrazide
CID 132992060
N'-[2-(2-methylphenyl)acetyl]pyridine-3-carbohydrazide
CID 35152193
N'-(3,3-dimethylbutanoyl)benzohydrazide
CID 24654425
N'-(2-amino-2-methylpropanoyl)pyridine-3-carbohydrazide
CID 67519841
N'-[4-(dimethylamino)benzoyl]pyridine-3-carbohydrazide
CID 25342800
2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide
CID 51163103
N-(2-phenylpropan-2-yl)pyridine-3-carboxamide
CID 47444755
N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide
CID 839627

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide?
The IUPAC name of 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide (CID 3968568) is 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide.
What is the SMILES notation for 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide?
The canonical SMILES for 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide is CC(C)(CC(=O)NNC(=O)c1cccnc1)CC(=O)N(c1ccccc1)c1ccccc1.
What is the InChIKey of 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide?
The InChIKey is OPQJWOIXMNENSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O3/c1-25(2,16-22(30)27-28-24(32)19-10-9-15-26-18-19)17-23(31)29(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-15,18H,16-17H2,1-2H3,(H,27,30)(H,28,32).
What are the key properties of 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide?
3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide has a molecular weight of 430.51 g/mol, XLogP of 4.01, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-5-oxo-N,N-diphenyl-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide is sourced from PubChem (CID 3968568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).