N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide

C21H24N2O — CID 110830986

IUPACN-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide
SMILESCc1ccc(C)c(NC(=O)Cn2ccc3cc(C(C)C)ccc32)c1
InChIInChI=1S/C21H24N2O/c1-14(2)17-7-8-20-18(12-17)9-10-23(20)13-21(24)22-19-11-15(3)5-6-16(19)4/h5-12,14H,13H2,1-4H3,(H,22,24)
InChIKeyOXLWMDARJQANMQ-UHFFFAOYSA-N
MW320.44 g/mol
LogP5.02
Rot. Bonds4

About N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide

N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide (PubChem CID 110830986) has the molecular formula C21H24N2O and a molecular weight of 320.44 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide
PubChem CID110830986
Molecular FormulaC21H24N2O
Molecular Weight320.44 g/mol
Exact Mass320.19
IUPAC NameN-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide
SMILESCc1ccc(C)c(NC(=O)Cn2ccc3cc(C(C)C)ccc32)c1
InChIInChI=1S/C21H24N2O/c1-14(2)17-7-8-20-18(12-17)9-10-23(20)13-21(24)22-19-11-15(3)5-6-16(19)4/h5-12,14H,13H2,1-4H3,(H,22,24)
InChIKeyOXLWMDARJQANMQ-UHFFFAOYSA-N
XLogP5.02
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.44
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-2-(5-propan-2-ylindol-1-yl)acetamide
CID 110831029
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 100734930
2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 100736460
2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide
CID 116622911
N-ethyl-2-(5-methylindol-1-yl)acetamide
CID 116623028
N-(2,5-dimethylphenyl)-2-(5-ethyl-4-oxopyrrolo[3,2-c]pyridin-1-yl)acetamide
CID 46395562
N-(2-methyl-5-propan-2-ylphenyl)-2-sulfanylacetamide
CID 21131547
N-(2,5-dimethylphenyl)-2-[1-[(2-methylphenyl)methyl]-7-oxopyrrolo[2,3-c]pyridin-6-yl]acetamide
CID 53164282
N-(2,5-dimethylphenyl)-2-[1-[(3-methylphenyl)methyl]-7-oxopyrrolo[2,3-c]pyridin-6-yl]acetamide
CID 53164256
2-(4-fluoro-3-methylphenyl)-2-[[2-(5-methylindol-1-yl)acetyl]amino]acetic acid
CID 166376773
N-(2-bromo-4,5-dimethylphenyl)-2-(5-bromoindol-1-yl)acetamide
CID 4048909
N-(2,5-dimethylphenyl)-3-(3-methylbutylamino)propanamide
CID 109032011

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide?
The IUPAC name of N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide (CID 110830986) is N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide is Cc1ccc(C)c(NC(=O)Cn2ccc3cc(C(C)C)ccc32)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide?
The InChIKey is OXLWMDARJQANMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O/c1-14(2)17-7-8-20-18(12-17)9-10-23(20)13-21(24)22-19-11-15(3)5-6-16(19)4/h5-12,14H,13H2,1-4H3,(H,22,24).
What are the key properties of N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide?
N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide has a molecular weight of 320.44 g/mol, XLogP of 5.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide is sourced from PubChem (CID 110830986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).