N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide

C22H24FN3O2 — CID 55559687

IUPACN-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2cc(C(=O)NCC(c3ccc(F)cc3)N3CCOCC3)[nH]c2c1
InChIInChI=1S/C22H24FN3O2/c1-15-2-3-17-13-20(25-19(17)12-15)22(27)24-14-21(26-8-10-28-11-9-26)16-4-6-18(23)7-5-16/h2-7,12-13,21,25H,8-11,14H2,1H3,(H,24,27)
InChIKeyHXMCOJDUKGNDOQ-UHFFFAOYSA-N
MW381.45 g/mol
LogP3.42
Rot. Bonds5

About N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide

N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide (PubChem CID 55559687) has the molecular formula C22H24FN3O2 and a molecular weight of 381.45 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide
PubChem CID55559687
Molecular FormulaC22H24FN3O2
Molecular Weight381.45 g/mol
Exact Mass381.19
IUPAC NameN-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2cc(C(=O)NCC(c3ccc(F)cc3)N3CCOCC3)[nH]c2c1
InChIInChI=1S/C22H24FN3O2/c1-15-2-3-17-13-20(25-19(17)12-15)22(27)24-14-21(26-8-10-28-11-9-26)16-4-6-18(23)7-5-16/h2-7,12-13,21,25H,8-11,14H2,1H3,(H,24,27)
InChIKeyHXMCOJDUKGNDOQ-UHFFFAOYSA-N
XLogP3.42
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.45
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4,5-dichloro-N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-1H-pyrrole-2-carboxamide
CID 86917092
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-(4-methylphenyl)acetamide
CID 17459584
N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-methylpropanamide
CID 30334846
4-methyl-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 30834547
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4,5-dimethylthiophene-2-carboxamide
CID 86978865
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4-methoxybenzamide
CID 30834690
N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
CID 37167600
1-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-3-[2-(6-methyl-1H-indol-3-yl)ethyl]urea
CID 86875671
2-(4-fluorophenyl)-N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]acetamide
CID 30834749
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2,3-dimethylbenzamide
CID 30878247
2-(4-fluorophenyl)-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 112506492
2-fluoro-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460592

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide?
The IUPAC name of N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide (CID 55559687) is N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide?
The canonical SMILES for N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide is Cc1ccc2cc(C(=O)NCC(c3ccc(F)cc3)N3CCOCC3)[nH]c2c1.
What is the InChIKey of N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide?
The InChIKey is HXMCOJDUKGNDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24FN3O2/c1-15-2-3-17-13-20(25-19(17)12-15)22(27)24-14-21(26-8-10-28-11-9-26)16-4-6-18(23)7-5-16/h2-7,12-13,21,25H,8-11,14H2,1H3,(H,24,27).
What are the key properties of N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide?
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide has a molecular weight of 381.45 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide is sourced from PubChem (CID 55559687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).