N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide

C24H28N2O2 — CID 84580289

IUPACN-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide
SMILESO=C(NCCc1c[nH]c2cc(OCc3ccccc3)ccc12)C1CCCCC1
InChIInChI=1S/C24H28N2O2/c27-24(19-9-5-2-6-10-19)25-14-13-20-16-26-23-15-21(11-12-22(20)23)28-17-18-7-3-1-4-8-18/h1,3-4,7-8,11-12,15-16,19,26H,2,5-6,9-10,13-14,17H2,(H,25,27)
InChIKeyCDQLPEUNGNOADS-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.99
Rot. Bonds7

About N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide

N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide (PubChem CID 84580289) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide
PubChem CID84580289
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC NameN-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide
SMILESO=C(NCCc1c[nH]c2cc(OCc3ccccc3)ccc12)C1CCCCC1
InChIInChI=1S/C24H28N2O2/c27-24(19-9-5-2-6-10-19)25-14-13-20-16-26-23-15-21(11-12-22(20)23)28-17-18-7-3-1-4-8-18/h1,3-4,7-8,11-12,15-16,19,26H,2,5-6,9-10,13-14,17H2,(H,25,27)
InChIKeyCDQLPEUNGNOADS-UHFFFAOYSA-N
XLogP4.99
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[6-(chloromethoxy)-1H-indol-3-yl]ethyl]cyclopropanecarboxamide
CID 57250361
tert-butyl N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]carbamate
CID 21071678
N-[2-(6-chloro-1H-indol-3-yl)ethyl]cyclobutanecarboxamide
CID 113083858
4-N-cyclopentyl-1-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1,4-dicarboxamide
CID 109145805
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]cyclohexanecarboxamide
CID 113083574
4-hydroxy-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide
CID 112528864
N-methyl-2-(5-phenylmethoxy-1H-indol-3-yl)ethanamine;oxalic acid
CID 25021298
methyl (2S)-2-amino-3-(6-phenylmethoxy-1H-indol-3-yl)propanoate
CID 94003873
2-[8-[2-(cyclohexanecarbonylamino)ethyl]naphthalen-2-yl]oxyacetic acid
CID 18783007
N-[2-(1H-indol-3-yl)ethyl]oxane-3-carboxamide
CID 110853395
[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] cyclohexanecarboxylate
CID 9017170
1-cyclohexyl-3-[2-(6-methyl-1H-indol-3-yl)ethyl]urea
CID 86875661

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide (CID 84580289) is N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide is O=C(NCCc1c[nH]c2cc(OCc3ccccc3)ccc12)C1CCCCC1.
What is the InChIKey of N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide?
The InChIKey is CDQLPEUNGNOADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c27-24(19-9-5-2-6-10-19)25-14-13-20-16-26-23-15-21(11-12-22(20)23)28-17-18-7-3-1-4-8-18/h1,3-4,7-8,11-12,15-16,19,26H,2,5-6,9-10,13-14,17H2,(H,25,27).
What are the key properties of N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide?
N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide has a molecular weight of 376.50 g/mol, XLogP of 4.99, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-phenylmethoxy-1H-indol-3-yl)ethyl]cyclohexanecarboxamide is sourced from PubChem (CID 84580289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).