N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide

C15H18N2O2 — CID 19967260

IUPACN-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide
SMILESCCc1ccc2[nH]cc(CONC(=O)C3CC3)c2c1
InChIInChI=1S/C15H18N2O2/c1-2-10-3-6-14-13(7-10)12(8-16-14)9-19-17-15(18)11-4-5-11/h3,6-8,11,16H,2,4-5,9H2,1H3,(H,17,18)
InChIKeyBOKMSJGWFVKIMR-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.69
Rot. Bonds5

About N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide

N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide (PubChem CID 19967260) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide
PubChem CID19967260
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide
SMILESCCc1ccc2[nH]cc(CONC(=O)C3CC3)c2c1
InChIInChI=1S/C15H18N2O2/c1-2-10-3-6-14-13(7-10)12(8-16-14)9-19-17-15(18)11-4-5-11/h3,6-8,11,16H,2,4-5,9H2,1H3,(H,17,18)
InChIKeyBOKMSJGWFVKIMR-UHFFFAOYSA-N
XLogP2.69
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine
CID 82490825
1-[2-(5-ethyl-1H-indol-3-yl)ethyl]cyclopropan-1-amine
CID 105486018
N-[4-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-2-oxoethyl]phenyl]cyclopropanecarboxamide
CID 71926324
ethane;N-[4-[(3-ethyl-1H-indol-5-yl)oxy]-3,5-dimethylphenyl]cyclohexanecarboxamide
CID 142086448
1-(5-ethyl-1H-indol-3-yl)-2-(methylamino)ethanone
CID 82493050
N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide
CID 19967333
1-N',4-N'-bis[2-(2-bromo-4-ethylphenoxy)acetyl]cyclohexane-1,4-dicarbohydrazide
CID 4927256
ethyl N-[[3-(cyanomethyl)-1H-indol-5-yl]methyl]carbamate
CID 131715970
3-ethyl-1H-indole-5-carboxylic acid
CID 70338709
methyl 3-ethyl-1H-indole-6-carboxylate
CID 22627226
N,N-dibenzyl-2-(5-ethyl-1H-indol-3-yl)ethanamine
CID 175502813
N-(5-ethyl-2-methoxyphenyl)cyclopropanecarboxamide
CID 110777232

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide?
The IUPAC name of N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide (CID 19967260) is N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide.
What is the SMILES notation for N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide?
The canonical SMILES for N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide is CCc1ccc2[nH]cc(CONC(=O)C3CC3)c2c1.
What is the InChIKey of N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide?
The InChIKey is BOKMSJGWFVKIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-10-3-6-14-13(7-10)12(8-16-14)9-19-17-15(18)11-4-5-11/h3,6-8,11,16H,2,4-5,9H2,1H3,(H,17,18).
What are the key properties of N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide?
N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide is sourced from PubChem (CID 19967260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).