N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide

C17H22N2O2 — CID 113084339

IUPACN-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide
SMILESCOc1ccc2[nH]cc(C(C)(C)CNC(=O)C3CC3)c2c1
InChIInChI=1S/C17H22N2O2/c1-17(2,10-19-16(20)11-4-5-11)14-9-18-15-7-6-12(21-3)8-13(14)15/h6-9,11,18H,4-5,10H2,1-3H3,(H,19,20)
InChIKeyNCAPCTZUXFQGAN-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.98
Rot. Bonds5

About N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide

N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide (PubChem CID 113084339) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide
PubChem CID113084339
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC NameN-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide
SMILESCOc1ccc2[nH]cc(C(C)(C)CNC(=O)C3CC3)c2c1
InChIInChI=1S/C17H22N2O2/c1-17(2,10-19-16(20)11-4-5-11)14-9-18-15-7-6-12(21-3)8-13(14)15/h6-9,11,18H,4-5,10H2,1-3H3,(H,19,20)
InChIKeyNCAPCTZUXFQGAN-UHFFFAOYSA-N
XLogP2.98
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]-2-(4-methoxyphenyl)acetamide
CID 113084367
N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]benzamide
CID 113084348
N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide
CID 113084050
N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]-3-phenoxypropanamide
CID 113084371
5-methoxy-3-(2-methylbutan-2-yl)-1H-indole
CID 106985577
3-(5-methoxy-1H-indol-3-yl)-3-methylbutan-1-amine
CID 84627056
N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]propane-1-sulfonamide
CID 113084400
N-cyclopentyl-2-(5-methoxy-1H-indol-3-yl)-2-methylpropanamide
CID 113210132
N-[4-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-2-oxoethyl]phenyl]cyclopropanecarboxamide
CID 71926324
N-[3-(dimethylamino)propyl]-2-(5-methoxy-1H-indol-3-yl)-2-methylpropanamide
CID 113210143
4-(5-methoxy-1H-indol-3-yl)cyclohexane-1-carboxylic acid
CID 83788644
tert-butyl N-[2-(5-chloro-1H-indol-3-yl)-2-methylpropyl]carbamate
CID 113084309

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide (CID 113084339) is N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide is COc1ccc2[nH]cc(C(C)(C)CNC(=O)C3CC3)c2c1.
What is the InChIKey of N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide?
The InChIKey is NCAPCTZUXFQGAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-17(2,10-19-16(20)11-4-5-11)14-9-18-15-7-6-12(21-3)8-13(14)15/h6-9,11,18H,4-5,10H2,1-3H3,(H,19,20).
What are the key properties of N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide?
N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide has a molecular weight of 286.38 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide is sourced from PubChem (CID 113084339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).