2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide

C19H28N2O2 — CID 42648833

IUPAC2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide
SMILESCOc1ccc2c(ccn2CC(=O)NC(C)CCCC(C)C)c1
InChIInChI=1S/C19H28N2O2/c1-14(2)6-5-7-15(3)20-19(22)13-21-11-10-16-12-17(23-4)8-9-18(16)21/h8-12,14-15H,5-7,13H2,1-4H3,(H,20,22)
InChIKeyZVEUYBGDMMBBJZ-UHFFFAOYSA-N
MW316.45 g/mol
LogP3.98
Rot. Bonds8

About 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide

2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide (PubChem CID 42648833) has the molecular formula C19H28N2O2 and a molecular weight of 316.45 g/mol. Its IUPAC name is 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide
PubChem CID42648833
Molecular FormulaC19H28N2O2
Molecular Weight316.45 g/mol
Exact Mass316.22
IUPAC Name2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide
SMILESCOc1ccc2c(ccn2CC(=O)NC(C)CCCC(C)C)c1
InChIInChI=1S/C19H28N2O2/c1-14(2)6-5-7-15(3)20-19(22)13-21-11-10-16-12-17(23-4)8-9-18(16)21/h8-12,14-15H,5-7,13H2,1-4H3,(H,20,22)
InChIKeyZVEUYBGDMMBBJZ-UHFFFAOYSA-N
XLogP3.98
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[[2-(5-methoxyindol-1-yl)acetyl]amino]propanoic acid
CID 39377928
5-(carbamoylamino)-2-[[2-(5-methoxyindol-1-yl)acetyl]amino]pentanoic acid
CID 71949551
N-tert-butyl-2-(5-methoxyindol-1-yl)acetamide
CID 115582184
N-[(2S)-1-(1H-indol-3-yl)propan-2-yl]-2-(5-methoxyindol-1-yl)acetamide
CID 29147453
N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide
CID 111447043
2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide
CID 116622911
2-(5-methoxyindol-1-yl)-N-prop-2-ynylacetamide
CID 115582181
N-(2-methylpropyl)-2-(5-propan-2-yloxyindol-1-yl)acetamide
CID 116625821
2-(5-methoxyindol-1-yl)-N-(1-propan-2-ylindol-4-yl)acetamide
CID 56763610
2-(5-methoxyindol-1-yl)-N-pyridin-2-ylacetamide
CID 29137208
2-(5-methoxyindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 29133435
methyl 4-[[2-(5-methoxyindol-1-yl)acetyl]amino]benzoate
CID 29135985

Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide?
The IUPAC name of 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide (CID 42648833) is 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide.
What is the SMILES notation for 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide?
The canonical SMILES for 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide is COc1ccc2c(ccn2CC(=O)NC(C)CCCC(C)C)c1.
What is the InChIKey of 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide?
The InChIKey is ZVEUYBGDMMBBJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-14(2)6-5-7-15(3)20-19(22)13-21-11-10-16-12-17(23-4)8-9-18(16)21/h8-12,14-15H,5-7,13H2,1-4H3,(H,20,22).
What are the key properties of 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide?
2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide has a molecular weight of 316.45 g/mol, XLogP of 3.98, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide is sourced from PubChem (CID 42648833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).