N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide

C20H18N2O2 — CID 89289825

IUPACN-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide
SMILESO=CC1(NC(=O)Cc2c[nH]c3ccccc23)Cc2ccccc2C1
InChIInChI=1S/C20H18N2O2/c23-13-20(10-14-5-1-2-6-15(14)11-20)22-19(24)9-16-12-21-18-8-4-3-7-17(16)18/h1-8,12-13,21H,9-11H2,(H,22,24)
InChIKeyJVVGPEZZACKZHH-UHFFFAOYSA-N
MW318.38 g/mol
LogP2.56
Rot. Bonds4

About N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide

N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide (PubChem CID 89289825) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide
PubChem CID89289825
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC NameN-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide
SMILESO=CC1(NC(=O)Cc2c[nH]c3ccccc23)Cc2ccccc2C1
InChIInChI=1S/C20H18N2O2/c23-13-20(10-14-5-1-2-6-15(14)11-20)22-19(24)9-16-12-21-18-8-4-3-7-17(16)18/h1-8,12-13,21H,9-11H2,(H,22,24)
InChIKeyJVVGPEZZACKZHH-UHFFFAOYSA-N
XLogP2.56
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
4-(1H-indol-3-yl)-N'-[2-(1H-indol-3-yl)acetyl]butanehydrazide
CID 29437828
2-(1H-indol-3-yl)-N-(3-methoxycyclobutyl)acetamide
CID 104578428
N-cyclopentyl-1-[[2-(1H-indol-3-yl)acetyl]amino]cyclohexane-1-carboxamide
CID 3993913
3-[[2-(1H-indol-3-yl)acetyl]amino]oxolane-3-carboxylic acid
CID 64890196
N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide
CID 43594469
N-cyclopropyl-4-(1H-indol-3-yl)butanamide
CID 729220
prop-2-enyl 2-(1H-indol-3-yl)acetate
CID 14701449
N-(1-amino-2-methylpropan-2-yl)-2-(1H-indol-3-yl)acetamide
CID 55163528
N-[1-(3-hydroxyazetidine-1-carbonyl)cyclopentyl]-2-(1H-indol-3-yl)acetamide
CID 75495447
N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
N-[2-(hydroxymethyl)phenyl]-2-(1H-indol-3-yl)acetamide
CID 60653710

Frequently Asked Questions

What is the IUPAC name of N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide (CID 89289825) is N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide is O=CC1(NC(=O)Cc2c[nH]c3ccccc23)Cc2ccccc2C1.
What is the InChIKey of N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide?
The InChIKey is JVVGPEZZACKZHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c23-13-20(10-14-5-1-2-6-15(14)11-20)22-19(24)9-16-12-21-18-8-4-3-7-17(16)18/h1-8,12-13,21H,9-11H2,(H,22,24).
What are the key properties of N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide?
N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide has a molecular weight of 318.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-formyl-1,3-dihydroinden-2-yl)-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 89289825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).