N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide

C17H24N2O3 — CID 111447043

IUPACN-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide
SMILESCOc1ccc2c(ccn2CC(=O)NCC(C)CC(C)O)c1
InChIInChI=1S/C17H24N2O3/c1-12(8-13(2)20)10-18-17(21)11-19-7-6-14-9-15(22-3)4-5-16(14)19/h4-7,9,12-13,20H,8,10-11H2,1-3H3,(H,18,21)
InChIKeyUQCOYZOUMWJWJE-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.17
Rot. Bonds7

About N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide

N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide (PubChem CID 111447043) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide
PubChem CID111447043
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide
SMILESCOc1ccc2c(ccn2CC(=O)NCC(C)CC(C)O)c1
InChIInChI=1S/C17H24N2O3/c1-12(8-13(2)20)10-18-17(21)11-19-7-6-14-9-15(22-3)4-5-16(14)19/h4-7,9,12-13,20H,8,10-11H2,1-3H3,(H,18,21)
InChIKeyUQCOYZOUMWJWJE-UHFFFAOYSA-N
XLogP2.17
TPSA63.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpropyl)-2-(5-propan-2-yloxyindol-1-yl)acetamide
CID 116625821
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(5-methoxyindol-1-yl)acetamide
CID 111120024
2-(5-methoxyindol-1-yl)-N-prop-2-ynylacetamide
CID 115582181
(2S)-2-[[2-(5-methoxyindol-1-yl)acetyl]amino]propanoic acid
CID 39377928
methyl 4-[[2-(5-methoxyindol-1-yl)acetyl]amino]benzoate
CID 29135985
N-tert-butyl-2-(5-methoxyindol-1-yl)acetamide
CID 115582184
2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide
CID 42648833
N-(2-hydroxy-2-phenylpropyl)-2-(5-methoxyindol-1-yl)acetamide
CID 111335212
ethyl 4-[[2-(5-methoxyindol-1-yl)acetyl]amino]benzoate
CID 29127327
N-[(3-bromophenyl)methyl]-2-(5-methoxyindol-1-yl)acetamide
CID 55718467
2-(5-chloroindol-1-yl)-N-(2-methylpropyl)acetamide
CID 39349235
2-(5-methoxyindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 29133435

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide?
The IUPAC name of N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide (CID 111447043) is N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide.
What is the SMILES notation for N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide?
The canonical SMILES for N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide is COc1ccc2c(ccn2CC(=O)NCC(C)CC(C)O)c1.
What is the InChIKey of N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide?
The InChIKey is UQCOYZOUMWJWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-12(8-13(2)20)10-18-17(21)11-19-7-6-14-9-15(22-3)4-5-16(14)19/h4-7,9,12-13,20H,8,10-11H2,1-3H3,(H,18,21).
What are the key properties of N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide?
N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide has a molecular weight of 304.39 g/mol, XLogP of 2.17, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-2-methylpentyl)-2-(5-methoxyindol-1-yl)acetamide is sourced from PubChem (CID 111447043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).