N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide

C24H28N2O2 — CID 52539141

IUPACN-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide
SMILESC=C(C)CN(CC)C(=O)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12
InChIInChI=1S/C24H28N2O2/c1-5-26(16-17(2)3)23(27)15-14-21-20-8-6-7-9-22(20)25-24(21)18-10-12-19(28-4)13-11-18/h6-13,25H,2,5,14-16H2,1,3-4H3
InChIKeyDHCBFUIHBFZBLV-UHFFFAOYSA-N
MW376.50 g/mol
LogP5.20
Rot. Bonds8

About N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide

N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide (PubChem CID 52539141) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide
PubChem CID52539141
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC NameN-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide
SMILESC=C(C)CN(CC)C(=O)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12
InChIInChI=1S/C24H28N2O2/c1-5-26(16-17(2)3)23(27)15-14-21-20-8-6-7-9-22(20)25-24(21)18-10-12-19(28-4)13-11-18/h6-13,25H,2,5,14-16H2,1,3-4H3
InChIKeyDHCBFUIHBFZBLV-UHFFFAOYSA-N
XLogP5.20
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.50
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-prop-2-enylpropanamide
CID 9076803
ethyl N-[2-[3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propanoylamino]ethyl]carbamate
CID 56558488
N-ethyl-2-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-methylethanamine
CID 59921071
3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylpropyl)propanamide
CID 17463237
3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-propan-2-yl-N-pyridin-3-ylpropanamide
CID 86847704
3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(5-methylhexan-2-yl)propanamide
CID 16566418
3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-[(2-methoxyphenyl)methyl]propanamide
CID 9083534
3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(1-methylpyrazol-3-yl)propanamide
CID 27034289
3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(6-methyl-2-pyridinyl)propanamide
CID 35505630
3-[3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propanoylamino]-2-methylpropanoic acid
CID 119237348
N-(1H-benzimidazol-2-yl)-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propanamide
CID 166194187
1-(3,5-dimethylpiperidin-1-yl)-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propan-1-one
CID 85458363

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide?
The IUPAC name of N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide (CID 52539141) is N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide.
What is the SMILES notation for N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide?
The canonical SMILES for N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide is C=C(C)CN(CC)C(=O)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12.
What is the InChIKey of N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide?
The InChIKey is DHCBFUIHBFZBLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c1-5-26(16-17(2)3)23(27)15-14-21-20-8-6-7-9-22(20)25-24(21)18-10-12-19(28-4)13-11-18/h6-13,25H,2,5,14-16H2,1,3-4H3.
What are the key properties of N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide?
N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide has a molecular weight of 376.50 g/mol, XLogP of 5.20, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-(2-methylprop-2-enyl)propanamide is sourced from PubChem (CID 52539141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).