N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide

C20H20N2O3 — CID 171674164

IUPACN-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide
SMILESCOc1ccc2c(CC(=O)N[C@H]3c4ccccc4C[C@H]3O)c[nH]c2c1
InChIInChI=1S/C20H20N2O3/c1-25-14-6-7-15-13(11-21-17(15)10-14)9-19(24)22-20-16-5-3-2-4-12(16)8-18(20)23/h2-7,10-11,18,20-21,23H,8-9H2,1H3,(H,22,24)/t18-,20+/m1/s1
InChIKeyYDVQZBPZKUGPTC-QUCCMNQESA-N
MW336.39 g/mol
LogP2.49
Rot. Bonds4

About N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide

N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide (PubChem CID 171674164) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide
PubChem CID171674164
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC NameN-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide
SMILESCOc1ccc2c(CC(=O)N[C@H]3c4ccccc4C[C@H]3O)c[nH]c2c1
InChIInChI=1S/C20H20N2O3/c1-25-14-6-7-15-13(11-21-17(15)10-14)9-19(24)22-20-16-5-3-2-4-12(16)8-18(20)23/h2-7,10-11,18,20-21,23H,8-9H2,1H3,(H,22,24)/t18-,20+/m1/s1
InChIKeyYDVQZBPZKUGPTC-QUCCMNQESA-N
XLogP2.49
TPSA74.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 52.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-2-(4-methyl-1H-indol-3-yl)acetamide
CID 111696322
N-(1,1-dioxothiolan-3-yl)-2-(6-methoxy-1H-indol-3-yl)acetamide
CID 110852767
N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxyacetamide
CID 101173546
N-[(1R,2R)-1-hydroxy-2,3-dihydro-1H-inden-2-yl]-2-(4-methoxyphenyl)acetamide
CID 97063534
N-(1-hydroxy-2,3-dihydro-1H-inden-2-yl)-2-(4-methoxyphenyl)acetamide
CID 71913320
N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 110903500
N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-6-methoxy-2H-chromene-3-carboxamide
CID 166186910
2-chloro-N-[(1R,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]acetamide
CID 70272915
6-methoxy-3-(piperidin-4-ylmethyl)-1H-indole
CID 82497673
N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]octanamide
CID 103816825
2-(5-methoxy-1H-indol-3-yl)-N-[(2-methylphenyl)methyl]acetamide
CID 113209591
1-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-3-[3-(3-methoxyphenyl)propyl]urea
CID 110929163

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide?
The IUPAC name of N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide (CID 171674164) is N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide?
The canonical SMILES for N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide is COc1ccc2c(CC(=O)N[C@H]3c4ccccc4C[C@H]3O)c[nH]c2c1.
What is the InChIKey of N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide?
The InChIKey is YDVQZBPZKUGPTC-QUCCMNQESA-N. The full InChI is InChI=1S/C20H20N2O3/c1-25-14-6-7-15-13(11-21-17(15)10-14)9-19(24)22-20-16-5-3-2-4-12(16)8-18(20)23/h2-7,10-11,18,20-21,23H,8-9H2,1H3,(H,22,24)/t18-,20+/m1/s1.
What are the key properties of N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide?
N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide has a molecular weight of 336.39 g/mol, XLogP of 2.49, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(6-methoxy-1H-indol-3-yl)acetamide is sourced from PubChem (CID 171674164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).