4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide

C20H22FN3O2 — CID 167932754

IUPAC4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCc1cc(F)c2c(c1)NC(C(=O)Nc1ccc(C3CNCCO3)cc1)C2
InChIInChI=1S/C20H22FN3O2/c1-12-8-16(21)15-10-18(24-17(15)9-12)20(25)23-14-4-2-13(3-5-14)19-11-22-6-7-26-19/h2-5,8-9,18-19,22,24H,6-7,10-11H2,1H3,(H,23,25)
InChIKeyPFKYIHCTHLNUTG-UHFFFAOYSA-N
MW355.41 g/mol
LogP2.77
Rot. Bonds3

About 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide

4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 167932754) has the molecular formula C20H22FN3O2 and a molecular weight of 355.41 g/mol. Its IUPAC name is 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound Name4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID167932754
Molecular FormulaC20H22FN3O2
Molecular Weight355.41 g/mol
Exact Mass355.17
IUPAC Name4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCc1cc(F)c2c(c1)NC(C(=O)Nc1ccc(C3CNCCO3)cc1)C2
InChIInChI=1S/C20H22FN3O2/c1-12-8-16(21)15-10-18(24-17(15)9-12)20(25)23-14-4-2-13(3-5-14)19-11-22-6-7-26-19/h2-5,8-9,18-19,22,24H,6-7,10-11H2,1H3,(H,23,25)
InChIKeyPFKYIHCTHLNUTG-UHFFFAOYSA-N
XLogP2.77
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.41
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-fluorophenyl)-N-[4-[(2S)-morpholin-2-yl]phenyl]pyrazolidine-3-carboxamide
CID 118704700
5-(3-cyano-4-fluorophenyl)-N-[4-[(2S)-morpholin-2-yl]phenyl]pyrazolidine-3-carboxamide
CID 118704720
4-methoxy-N-(4-morpholin-2-ylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 67238948
4-chloro-2-fluoro-N-[4-[(2S)-morpholin-2-yl]phenyl]benzamide;4-chloro-2-fluoro-N-[4-[(2R)-morpholin-2-yl]phenyl]benzamide
CID 159688298
tert-butyl N-(4-morpholin-2-ylphenyl)carbamate
CID 117446363
8-fluoro-2-methyl-N-(4-morpholin-2-ylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 167847716
4-chloro-2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]benzamide
CID 130184022
5-(3-methoxyphenyl)-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazolidine-3-carboxamide
CID 118704712
2-(4-fluorophenyl)-N-[4-[(2S)-morpholin-2-yl]phenyl]-3,4-dihydropyrazole-5-carboxamide
CID 71113263
2-(4-fluorophenyl)-N-[4-[(2R)-morpholin-2-yl]phenyl]-3,4-dihydropyrazole-5-carboxamide
CID 71113057
6-fluoro-4-methyl-N-(4-morpholin-2-ylphenyl)-1H-indole-2-carboxamide
CID 167826713
4-methoxy-N-(4-morpholin-2-ylphenyl)benzamide;hydrochloride
CID 67239468

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide (CID 167932754) is 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide is Cc1cc(F)c2c(c1)NC(C(=O)Nc1ccc(C3CNCCO3)cc1)C2.
What is the InChIKey of 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is PFKYIHCTHLNUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O2/c1-12-8-16(21)15-10-18(24-17(15)9-12)20(25)23-14-4-2-13(3-5-14)19-11-22-6-7-26-19/h2-5,8-9,18-19,22,24H,6-7,10-11H2,1H3,(H,23,25).
What are the key properties of 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 355.41 g/mol, XLogP of 2.77, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-methyl-N-(4-morpholin-2-ylphenyl)-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 167932754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).