6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide

C20H21N3O3 — CID 113206662

IUPAC6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide
SMILESCOc1ccc2c(C(=O)Nc3ccccc3N3CCOCC3)c[nH]c2c1
InChIInChI=1S/C20H21N3O3/c1-25-14-6-7-15-16(13-21-18(15)12-14)20(24)22-17-4-2-3-5-19(17)23-8-10-26-11-9-23/h2-7,12-13,21H,8-11H2,1H3,(H,22,24)
InChIKeyNANSYSAVBGQUMR-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.27
Rot. Bonds4

About 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide

6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide (PubChem CID 113206662) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide
PubChem CID113206662
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide
SMILESCOc1ccc2c(C(=O)Nc3ccccc3N3CCOCC3)c[nH]c2c1
InChIInChI=1S/C20H21N3O3/c1-25-14-6-7-15-16(13-21-18(15)12-14)20(24)22-17-4-2-3-5-19(17)23-8-10-26-11-9-23/h2-7,12-13,21H,8-11H2,1H3,(H,22,24)
InChIKeyNANSYSAVBGQUMR-UHFFFAOYSA-N
XLogP3.27
TPSA66.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-fluoro-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide
CID 113206299
N-(3-chloro-2-methylphenyl)-6-methoxy-1H-indole-3-carboxamide
CID 113206624
1-(3-methoxyphenyl)-3-(2-morpholin-4-ylphenyl)urea
CID 108869153
2-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109009056
2,4-dimethoxy-N-(2-piperidin-1-ylphenyl)benzamide
CID 6457289
2-hydroxy-5-methoxy-N-(2-piperidin-1-ylphenyl)benzamide
CID 112809580
4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide
CID 6473304
3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 109039568
6-amino-N-(2-methoxyphenyl)-1H-indole-3-carboxamide
CID 61089726
2-morpholin-4-ylethyl 2-(6-methoxy-1H-indol-3-yl)-2-oxoacetate
CID 44595123
2,4-difluoro-N-(2-morpholin-4-ylphenyl)benzamide
CID 3662242
N-[4-(4-methoxyphenoxy)phenyl]-2-morpholin-4-ylbenzamide
CID 131937049

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide?
The IUPAC name of 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide (CID 113206662) is 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide.
What is the SMILES notation for 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide?
The canonical SMILES for 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide is COc1ccc2c(C(=O)Nc3ccccc3N3CCOCC3)c[nH]c2c1.
What is the InChIKey of 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide?
The InChIKey is NANSYSAVBGQUMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-25-14-6-7-15-16(13-21-18(15)12-14)20(24)22-17-4-2-3-5-19(17)23-8-10-26-11-9-23/h2-7,12-13,21H,8-11H2,1H3,(H,22,24).
What are the key properties of 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide?
6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 113206662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).