N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide

C18H20N2O — CID 120568967

IUPACN-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide
SMILESCc1ccc(N)cc1NC(=O)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C18H20N2O/c1-12-5-8-16(19)11-17(12)20-18(21)10-13-6-7-14-3-2-4-15(14)9-13/h5-9,11H,2-4,10,19H2,1H3,(H,20,21)
InChIKeyCMEIMROEKFZDJU-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.25
Rot. Bonds3

About N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide

N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide (PubChem CID 120568967) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide.

Molecular Properties

Compound NameN-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide
PubChem CID120568967
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide
SMILESCc1ccc(N)cc1NC(=O)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C18H20N2O/c1-12-5-8-16(19)11-17(12)20-18(21)10-13-6-7-14-3-2-4-15(14)9-13/h5-9,11H,2-4,10,19H2,1H3,(H,20,21)
InChIKeyCMEIMROEKFZDJU-UHFFFAOYSA-N
XLogP3.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-2-methylphenyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 18072524
N-(2-methyl-5-methylsulfonylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 34194248
N-(5-amino-2-methylphenyl)-3-(2,6-dioxopiperidin-1-yl)propanamide
CID 43447503
2-(2,3-dihydro-1H-inden-5-yl)-N-[2-methyl-5-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide
CID 55545741
N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 8637936
N-(2-fluoro-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 34749475
2-(2,3-dihydro-1H-inden-5-yl)-N-(2-methylsulfanylphenyl)acetamide
CID 55358221
2-(2,3-dihydro-1H-inden-5-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 16556750
N-(5-amino-2-methylphenyl)-3-(2-oxopyrrolidin-1-yl)propanamide
CID 16794289
2-(2,3-dihydro-1H-inden-5-yl)-N-propan-2-ylacetamide
CID 60645732
N-[5-chloro-2-(dimethylamino)phenyl]-2-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 55358736
2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 26955686

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide?
The IUPAC name of N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide (CID 120568967) is N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide.
What is the SMILES notation for N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide?
The canonical SMILES for N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide is Cc1ccc(N)cc1NC(=O)Cc1ccc2c(c1)CCC2.
What is the InChIKey of N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide?
The InChIKey is CMEIMROEKFZDJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-12-5-8-16(19)11-17(12)20-18(21)10-13-6-7-14-3-2-4-15(14)9-13/h5-9,11H,2-4,10,19H2,1H3,(H,20,21).
What are the key properties of N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide?
N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide is sourced from PubChem (CID 120568967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).