N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide

C29H26N2O2 — CID 118014487

IUPACN-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(C(C(=O)NO)c2c(-c3ccc4ccccc4c3)[nH]c3ccccc23)cc1
InChIInChI=1S/C29H26N2O2/c1-18(2)19-11-14-21(15-12-19)26(29(32)31-33)27-24-9-5-6-10-25(24)30-28(27)23-16-13-20-7-3-4-8-22(20)17-23/h3-18,26,30,33H,1-2H3,(H,31,32)
InChIKeyIXYPNNKEQPKEKR-UHFFFAOYSA-N
MW434.54 g/mol
LogP6.75
Rot. Bonds5

About N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide

N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide (PubChem CID 118014487) has the molecular formula C29H26N2O2 and a molecular weight of 434.54 g/mol. Its IUPAC name is N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound NameN-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide
PubChem CID118014487
Molecular FormulaC29H26N2O2
Molecular Weight434.54 g/mol
Exact Mass434.20
IUPAC NameN-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(C(C(=O)NO)c2c(-c3ccc4ccccc4c3)[nH]c3ccccc23)cc1
InChIInChI=1S/C29H26N2O2/c1-18(2)19-11-14-21(15-12-19)26(29(32)31-33)27-24-9-5-6-10-25(24)30-28(27)23-16-13-20-7-3-4-8-22(20)17-23/h3-18,26,30,33H,1-2H3,(H,31,32)
InChIKeyIXYPNNKEQPKEKR-UHFFFAOYSA-N
XLogP6.75
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.54
LogP ≤ 56.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide (CID 118014487) is N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide is CC(C)c1ccc(C(C(=O)NO)c2c(-c3ccc4ccccc4c3)[nH]c3ccccc23)cc1.
What is the InChIKey of N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide?
The InChIKey is IXYPNNKEQPKEKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N2O2/c1-18(2)19-11-14-21(15-12-19)26(29(32)31-33)27-24-9-5-6-10-25(24)30-28(27)23-16-13-20-7-3-4-8-22(20)17-23/h3-18,26,30,33H,1-2H3,(H,31,32).
What are the key properties of N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide?
N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide has a molecular weight of 434.54 g/mol, XLogP of 6.75, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-(2-naphthalen-2-yl-1H-indol-3-yl)-2-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 118014487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).