5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide

C13H16N2O3 — CID 10753063

IUPAC5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide
SMILESCOc1ccc2[nH]c(C(N)=O)c(OC(C)C)c2c1
InChIInChI=1S/C13H16N2O3/c1-7(2)18-12-9-6-8(17-3)4-5-10(9)15-11(12)13(14)16/h4-7,15H,1-3H3,(H2,14,16)
InChIKeyNRBFSKQNLRSXRV-UHFFFAOYSA-N
MW248.28 g/mol
LogP2.06
Rot. Bonds4

About 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide

5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide (PubChem CID 10753063) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide
PubChem CID10753063
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC Name5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide
SMILESCOc1ccc2[nH]c(C(N)=O)c(OC(C)C)c2c1
InChIInChI=1S/C13H16N2O3/c1-7(2)18-12-9-6-8(17-3)4-5-10(9)15-11(12)13(14)16/h4-7,15H,1-3H3,(H2,14,16)
InChIKeyNRBFSKQNLRSXRV-UHFFFAOYSA-N
XLogP2.06
TPSA77.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methoxy-2-(piperidine-1-carbonyl)-1H-indole-3-diazonium
CID 10731761
2-(6-methoxy-4-oxo-1H-quinolin-2-yl)acetamide
CID 25174598
6-methoxy-3-methyl-N-(4-propan-2-yloxyphenyl)-1H-indole-2-carboxamide
CID 113205504
5-methoxy-3-methyl-N-(3-methylbutyl)-1H-indole-2-carboxamide
CID 113204847
1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
CID 604823
3-amino-6-methoxy-2-oxo-1H-quinoline-4-carboxylic acid
CID 115039979
N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide
CID 113204869
ethyl 3-(2-ethoxy-2-oxoethyl)-5-methoxy-1H-indole-2-carboxylate
CID 10590673
ethyl 3-propan-2-yloxy-1H-indole-2-carboxylate
CID 67372347
5-methoxy-3-[1-(methylcarbamoylamino)propan-2-yl]-1H-indole-2-carboxylic acid
CID 118071490
ethyl 3-[(dimethylamino)methyl]-5-methoxy-1H-indole-2-carboxylate
CID 907671
ethyl 3-(ethoxycarbonylamino)-5-methoxy-1H-indole-2-carboxylate
CID 6615701

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide?
The IUPAC name of 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide (CID 10753063) is 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide.
What is the SMILES notation for 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide?
The canonical SMILES for 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide is COc1ccc2[nH]c(C(N)=O)c(OC(C)C)c2c1.
What is the InChIKey of 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide?
The InChIKey is NRBFSKQNLRSXRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-7(2)18-12-9-6-8(17-3)4-5-10(9)15-11(12)13(14)16/h4-7,15H,1-3H3,(H2,14,16).
What are the key properties of 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide?
5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide has a molecular weight of 248.28 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-propan-2-yloxy-1H-indole-2-carboxamide is sourced from PubChem (CID 10753063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).