4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine

C24H28FN3O — CID 170159206

IUPAC4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine
SMILESCc1ccc(F)c2ccn(-c3cccc(N4CCC(N5CCOCC5)CC4)c3)c12
InChIInChI=1S/C24H28FN3O/c1-18-5-6-23(25)22-9-12-28(24(18)22)21-4-2-3-20(17-21)26-10-7-19(8-11-26)27-13-15-29-16-14-27/h2-6,9,12,17,19H,7-8,10-11,13-16H2,1H3
InChIKeyINOKOTNFRSORJK-UHFFFAOYSA-N
MW393.51 g/mol
LogP4.38
Rot. Bonds3

About 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine

4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine (PubChem CID 170159206) has the molecular formula C24H28FN3O and a molecular weight of 393.51 g/mol. Its IUPAC name is 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine
PubChem CID170159206
Molecular FormulaC24H28FN3O
Molecular Weight393.51 g/mol
Exact Mass393.22
IUPAC Name4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine
SMILESCc1ccc(F)c2ccn(-c3cccc(N4CCC(N5CCOCC5)CC4)c3)c12
InChIInChI=1S/C24H28FN3O/c1-18-5-6-23(25)22-9-12-28(24(18)22)21-4-2-3-20(17-21)26-10-7-19(8-11-26)27-13-15-29-16-14-27/h2-6,9,12,17,19H,7-8,10-11,13-16H2,1H3
InChIKeyINOKOTNFRSORJK-UHFFFAOYSA-N
XLogP4.38
TPSA20.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.51
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-7-methyl-1-[3-(4-phenylpiperazin-1-yl)phenyl]indole
CID 170158290
3-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]propan-1-amine
CID 170159411
1-cyclopropyl-4-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperazin-2-one
CID 175896358
4-fluoro-7-methyl-1-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]indole
CID 170158402
4-[1-(3,5-dimethyl-4-nitrophenyl)piperidin-4-yl]morpholine
CID 144594517
4-[1-(3-fluoro-4-methylphenyl)piperidin-4-yl]thiomorpholine
CID 91362707
4-fluoro-7-methyl-N-[3-[4-(oxan-4-yl)piperazin-1-yl]phenyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 146395048
4-[1-(3-fluoro-2-nitrophenyl)pyrrolidin-3-yl]morpholine
CID 63171297
4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine
CID 171691128
1-[5-fluoro-2-[3-(4-morpholin-4-ylpiperidin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxylic acid
CID 151466671
1-[5-fluoro-2-[3-(4-morpholin-4-ylpiperidin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide
CID 139408201
N-[(3-fluoro-4-methylphenyl)methyl]-N'-methyl-3-morpholin-4-ylpyrrolidine-1-carboximidamide;hydroiodide
CID 111726634

Frequently Asked Questions

What is the IUPAC name of 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine?
The IUPAC name of 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine (CID 170159206) is 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine.
What is the SMILES notation for 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine?
The canonical SMILES for 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine is Cc1ccc(F)c2ccn(-c3cccc(N4CCC(N5CCOCC5)CC4)c3)c12.
What is the InChIKey of 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine?
The InChIKey is INOKOTNFRSORJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28FN3O/c1-18-5-6-23(25)22-9-12-28(24(18)22)21-4-2-3-20(17-21)26-10-7-19(8-11-26)27-13-15-29-16-14-27/h2-6,9,12,17,19H,7-8,10-11,13-16H2,1H3.
What are the key properties of 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine?
4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine has a molecular weight of 393.51 g/mol, XLogP of 4.38, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[3-(4-fluoro-7-methylindol-1-yl)phenyl]piperidin-4-yl]morpholine is sourced from PubChem (CID 170159206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).