2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide

C22H26N2O2 — CID 97161769

IUPAC2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide
SMILESCOc1cccc2ccn(CC(=O)N[C@@H](C)CCCc3ccccc3)c12
InChIInChI=1S/C22H26N2O2/c1-17(8-6-11-18-9-4-3-5-10-18)23-21(25)16-24-15-14-19-12-7-13-20(26-2)22(19)24/h3-5,7,9-10,12-15,17H,6,8,11,16H2,1-2H3,(H,23,25)/t17-/m0/s1
InChIKeyFMUNAYXTYSZPEF-KRWDZBQOSA-N
MW350.46 g/mol
LogP4.18
Rot. Bonds8

About 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide

2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide (PubChem CID 97161769) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide.

Molecular Properties

Compound Name2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide
PubChem CID97161769
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide
SMILESCOc1cccc2ccn(CC(=O)N[C@@H](C)CCCc3ccccc3)c12
InChIInChI=1S/C22H26N2O2/c1-17(8-6-11-18-9-4-3-5-10-18)23-21(25)16-24-15-14-19-12-7-13-20(26-2)22(19)24/h3-5,7,9-10,12-15,17H,6,8,11,16H2,1-2H3,(H,23,25)/t17-/m0/s1
InChIKeyFMUNAYXTYSZPEF-KRWDZBQOSA-N
XLogP4.18
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(7-methoxyindol-1-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 39331953
2-(7-methoxyindol-1-yl)-N-(1-phenylethyl)acetamide
CID 42653944
2-(7-methoxyindol-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 39348357
N-(2-methoxyethyl)-2-(7-methoxyindol-1-yl)acetamide
CID 39315359
2-[3-(7-methoxyindol-1-yl)propanoylamino]-3-methylpentanoic acid
CID 75269590
(2S)-1-(7-methoxyindol-1-yl)propan-2-amine
CID 173286009
2-[7-(aminomethyl)indol-1-yl]-N-pentan-2-ylacetamide
CID 102913404
2-(4-methoxyindol-1-yl)-N-pentan-2-ylacetamide
CID 83174347
7-methoxy-1-[3-[4-(2-phenylethyl)-1,4-diazepan-1-yl]propyl]indole
CID 143503177
1-(2,6-dimethoxyphenyl)-4-phenylbutan-1-ol
CID 115791096
[(2R)-5-phenylpentan-2-yl]urea
CID 70818024
2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide
CID 42648833

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide?
The IUPAC name of 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide (CID 97161769) is 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide.
What is the SMILES notation for 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide?
The canonical SMILES for 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide is COc1cccc2ccn(CC(=O)N[C@@H](C)CCCc3ccccc3)c12.
What is the InChIKey of 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide?
The InChIKey is FMUNAYXTYSZPEF-KRWDZBQOSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-17(8-6-11-18-9-4-3-5-10-18)23-21(25)16-24-15-14-19-12-7-13-20(26-2)22(19)24/h3-5,7,9-10,12-15,17H,6,8,11,16H2,1-2H3,(H,23,25)/t17-/m0/s1.
What are the key properties of 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide?
2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide has a molecular weight of 350.46 g/mol, XLogP of 4.18, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxyindol-1-yl)-N-[(2S)-5-phenylpentan-2-yl]acetamide is sourced from PubChem (CID 97161769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).