2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide

C19H18N6O2 — CID 136576879

IUPAC2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide
SMILESCOc1ccc2[nH]cc(CC(=O)Nc3cccc(-c4nnnn4C)c3)c2c1
InChIInChI=1S/C19H18N6O2/c1-25-19(22-23-24-25)12-4-3-5-14(8-12)21-18(26)9-13-11-20-17-7-6-15(27-2)10-16(13)17/h3-8,10-11,20H,9H2,1-2H3,(H,21,26)
InChIKeyQEXYARKLBDUMOG-UHFFFAOYSA-N
MW362.39 g/mol
LogP2.55
Rot. Bonds5

About 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide

2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide (PubChem CID 136576879) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide
PubChem CID136576879
Molecular FormulaC19H18N6O2
Molecular Weight362.39 g/mol
Exact Mass362.15
IUPAC Name2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide
SMILESCOc1ccc2[nH]cc(CC(=O)Nc3cccc(-c4nnnn4C)c3)c2c1
InChIInChI=1S/C19H18N6O2/c1-25-19(22-23-24-25)12-4-3-5-14(8-12)21-18(26)9-13-11-20-17-7-6-15(27-2)10-16(13)17/h3-8,10-11,20H,9H2,1-2H3,(H,21,26)
InChIKeyQEXYARKLBDUMOG-UHFFFAOYSA-N
XLogP2.55
TPSA97.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(5-methoxy-1H-indol-3-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 78873771
N-[3-(hydroxymethyl)phenyl]-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 110910870
N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 113209668
2-(4-methylphenoxy)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide
CID 26122709
N-[3-(1-methyltetrazol-5-yl)phenyl]-2-thiophen-3-ylacetamide
CID 30414133
N-(2,6-dichlorophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 113209712
2-(5-methoxy-1H-indol-3-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113209654
2-[(2-methylpropan-2-yl)oxy]-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide
CID 115949897
N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-2-(1H-indol-3-yl)acetamide
CID 32582075
2-(5-methoxy-1H-indol-3-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide
CID 166234147
3-amino-3-methyl-N-[3-(1-methyltetrazol-5-yl)phenyl]butanamide
CID 64684421
N-[4-[[3-(1-methyltetrazol-5-yl)phenyl]carbamoylamino]phenyl]propanamide
CID 48783055

Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide?
The IUPAC name of 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide (CID 136576879) is 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide.
What is the SMILES notation for 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide?
The canonical SMILES for 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide is COc1ccc2[nH]cc(CC(=O)Nc3cccc(-c4nnnn4C)c3)c2c1.
What is the InChIKey of 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide?
The InChIKey is QEXYARKLBDUMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O2/c1-25-19(22-23-24-25)12-4-3-5-14(8-12)21-18(26)9-13-11-20-17-7-6-15(27-2)10-16(13)17/h3-8,10-11,20H,9H2,1-2H3,(H,21,26).
What are the key properties of 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide?
2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide has a molecular weight of 362.39 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-1H-indol-3-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]acetamide is sourced from PubChem (CID 136576879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).