N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide

C20H22N2O3 — CID 95598350

IUPACN-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide
SMILESCOc1ccc2[nH]cc(CC(=O)NC[C@H](O)Cc3ccccc3)c2c1
InChIInChI=1S/C20H22N2O3/c1-25-17-7-8-19-18(11-17)15(12-21-19)10-20(24)22-13-16(23)9-14-5-3-2-4-6-14/h2-8,11-12,16,21,23H,9-10,13H2,1H3,(H,22,24)/t16-/m1/s1
InChIKeyITWYRPZBGVMPOL-MRXNPFEDSA-N
MW338.41 g/mol
LogP2.44
Rot. Bonds7

About N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide

N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide (PubChem CID 95598350) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide
PubChem CID95598350
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide
SMILESCOc1ccc2[nH]cc(CC(=O)NC[C@H](O)Cc3ccccc3)c2c1
InChIInChI=1S/C20H22N2O3/c1-25-17-7-8-19-18(11-17)15(12-21-19)10-20(24)22-13-16(23)9-14-5-3-2-4-6-14/h2-8,11-12,16,21,23H,9-10,13H2,1H3,(H,22,24)/t16-/m1/s1
InChIKeyITWYRPZBGVMPOL-MRXNPFEDSA-N
XLogP2.44
TPSA74.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxypropyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 78872247
N-(2-hydroxy-3-phenylpropyl)-2-(3-methoxyphenyl)acetamide
CID 90534339
2-(5-methoxy-1H-indol-3-yl)-N-[(2-methylphenyl)methyl]acetamide
CID 113209591
N-(3-hydroxybutyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 111433362
2-(5-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide
CID 110847876
1-benzyl-3-[2-(5-methoxy-1H-indol-3-yl)ethyl]urea
CID 18947306
(2S)-2-[[2-[[2-(5-methoxy-1H-indol-3-yl)acetyl]amino]acetyl]amino]-4-methylpentanoic acid
CID 120694580
(2S)-2-amino-3-(5-methoxy-1H-indol-3-yl)propanoic acid
CID 175665456
N-[3-(hydroxymethyl)phenyl]-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 110910870
N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 60610770
N-[(5-methoxy-1H-indol-3-yl)methyl]acetamide
CID 71554009
N-(2-hydroxy-3-phenylpropyl)-3-(3-methoxyphenyl)propanamide
CID 111102377

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide?
The IUPAC name of N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide (CID 95598350) is N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide?
The canonical SMILES for N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide is COc1ccc2[nH]cc(CC(=O)NC[C@H](O)Cc3ccccc3)c2c1.
What is the InChIKey of N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide?
The InChIKey is ITWYRPZBGVMPOL-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-25-17-7-8-19-18(11-17)15(12-21-19)10-20(24)22-13-16(23)9-14-5-3-2-4-6-14/h2-8,11-12,16,21,23H,9-10,13H2,1H3,(H,22,24)/t16-/m1/s1.
What are the key properties of N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide?
N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide has a molecular weight of 338.41 g/mol, XLogP of 2.44, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-methoxy-1H-indol-3-yl)acetamide is sourced from PubChem (CID 95598350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).