4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide

C22H23N5O2 — CID 75447935

IUPAC4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide
SMILESCc1cc(C)n(-c2ccc(C(=O)Nc3ccccc3CN3CCNC3=O)cc2)n1
InChIInChI=1S/C22H23N5O2/c1-15-13-16(2)27(25-15)19-9-7-17(8-10-19)21(28)24-20-6-4-3-5-18(20)14-26-12-11-23-22(26)29/h3-10,13H,11-12,14H2,1-2H3,(H,23,29)(H,24,28)
InChIKeyMSSLKKLHSJUSGD-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.27
Rot. Bonds5

About 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide

4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide (PubChem CID 75447935) has the molecular formula C22H23N5O2 and a molecular weight of 389.46 g/mol. Its IUPAC name is 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide.

Molecular Properties

Compound Name4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide
PubChem CID75447935
Molecular FormulaC22H23N5O2
Molecular Weight389.46 g/mol
Exact Mass389.19
IUPAC Name4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide
SMILESCc1cc(C)n(-c2ccc(C(=O)Nc3ccccc3CN3CCNC3=O)cc2)n1
InChIInChI=1S/C22H23N5O2/c1-15-13-16(2)27(25-15)19-9-7-17(8-10-19)21(28)24-20-6-4-3-5-18(20)14-26-12-11-23-22(26)29/h3-10,13H,11-12,14H2,1-2H3,(H,23,29)(H,24,28)
InChIKeyMSSLKKLHSJUSGD-UHFFFAOYSA-N
XLogP3.27
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,5-dimethylpyrazol-1-yl)-N-(2-methylphenyl)benzamide
CID 2354201
3-fluoro-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide
CID 75517433
N-[2-[[4-(3,5-dimethylpyrazol-1-yl)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide
CID 55972966
4-(3,5-dimethylpyrazol-1-yl)-N-(2-propan-2-ylphenyl)benzamide
CID 9110177
4-(3,5-dimethylpyrazol-1-yl)-N-[2-(2,2,2-trifluoroethylamino)phenyl]benzamide
CID 47829643
4-(3,5-dimethylpyrazol-1-yl)-N-[2-(piperidine-1-carbonyl)phenyl]benzamide
CID 26905415
2-(3-methylphenyl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]acetamide
CID 75472823
N-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-4-(3,5-dimethylpyrazol-1-yl)benzamide
CID 155919513
4-(3,5-dimethylpyrazol-1-yl)-N-[3-methyl-2-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 55715651
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 43073960
N-(2-aminophenyl)-4-(3,5-dimethylpyrazol-1-yl)benzamide;4-(3,5-dimethylpyrazol-1-yl)benzoic acid;4-hydrazinylbenzoic acid
CID 162052991
4-(3,5-dimethylpyrazol-1-yl)-N-naphthalen-2-ylbenzamide
CID 2353958

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide?
The IUPAC name of 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide (CID 75447935) is 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide.
What is the SMILES notation for 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide?
The canonical SMILES for 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide is Cc1cc(C)n(-c2ccc(C(=O)Nc3ccccc3CN3CCNC3=O)cc2)n1.
What is the InChIKey of 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide?
The InChIKey is MSSLKKLHSJUSGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O2/c1-15-13-16(2)27(25-15)19-9-7-17(8-10-19)21(28)24-20-6-4-3-5-18(20)14-26-12-11-23-22(26)29/h3-10,13H,11-12,14H2,1-2H3,(H,23,29)(H,24,28).
What are the key properties of 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide?
4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide has a molecular weight of 389.46 g/mol, XLogP of 3.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide is sourced from PubChem (CID 75447935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).