N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide

C22H24N4O3 — CID 46378680

IUPACN-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide
SMILESCc1ccc(NC(=O)Cn2nc(C(=O)N3CCOCC3)c3ccccc32)c(C)c1
InChIInChI=1S/C22H24N4O3/c1-15-7-8-18(16(2)13-15)23-20(27)14-26-19-6-4-3-5-17(19)21(24-26)22(28)25-9-11-29-12-10-25/h3-8,13H,9-12,14H2,1-2H3,(H,23,27)
InChIKeyZBRPPPRMAIUUIN-UHFFFAOYSA-N
MW392.46 g/mol
LogP2.76
Rot. Bonds4

About N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide

N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide (PubChem CID 46378680) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide
PubChem CID46378680
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC NameN-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide
SMILESCc1ccc(NC(=O)Cn2nc(C(=O)N3CCOCC3)c3ccccc32)c(C)c1
InChIInChI=1S/C22H24N4O3/c1-15-7-8-18(16(2)13-15)23-20(27)14-26-19-6-4-3-5-17(19)21(24-26)22(28)25-9-11-29-12-10-25/h3-8,13H,9-12,14H2,1-2H3,(H,23,27)
InChIKeyZBRPPPRMAIUUIN-UHFFFAOYSA-N
XLogP2.76
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-methyl-2-pyridinyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide
CID 46378664
N-(3-chlorophenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide
CID 46378667
N-(2,4-dimethylphenyl)-2-[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]sulfanylacetamide
CID 20902511
N-(2,5-dimethylphenyl)-2-[4-(morpholine-4-carbonyl)-2-oxoquinolin-1-yl]acetamide
CID 17251117
N-(4-acetylphenyl)-2-[3-(pyrrolidine-1-carbonyl)indazol-1-yl]acetamide
CID 46378627
2-(benzotriazol-1-yl)-N-(2,4-dimethylphenyl)acetamide
CID 856334
N-(2,4-dimethylphenyl)-3-(morpholine-4-carbonyl)benzamide
CID 109052893
2-(3-methylindazol-1-yl)-N-(2-methylphenyl)acetamide
CID 20886113
N-(2,3-dimethylphenyl)-2-[4-(morpholine-4-carbonyl)-2-oxoquinolin-1-yl]acetamide
CID 17251039
1-piperidin-1-yl-2-[3-(pyrrolidine-1-carbonyl)indazol-1-yl]ethanone
CID 46378636
N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide
CID 802610
3-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
CID 2521587

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide (CID 46378680) is N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide is Cc1ccc(NC(=O)Cn2nc(C(=O)N3CCOCC3)c3ccccc32)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide?
The InChIKey is ZBRPPPRMAIUUIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-15-7-8-18(16(2)13-15)23-20(27)14-26-19-6-4-3-5-17(19)21(24-26)22(28)25-9-11-29-12-10-25/h3-8,13H,9-12,14H2,1-2H3,(H,23,27).
What are the key properties of N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide?
N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide has a molecular weight of 392.46 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-[3-(morpholine-4-carbonyl)indazol-1-yl]acetamide is sourced from PubChem (CID 46378680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).