(1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone

C22H31N3O2 — CID 95896712

IUPAC(1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
SMILESCCn1ccc2cc(C(=O)N3CCC([C@@H](C)N4CCOCC4)CC3)ccc21
InChIInChI=1S/C22H31N3O2/c1-3-23-9-8-19-16-20(4-5-21(19)23)22(26)25-10-6-18(7-11-25)17(2)24-12-14-27-15-13-24/h4-5,8-9,16-18H,3,6-7,10-15H2,1-2H3/t17-/m1/s1
InChIKeyKGXKNHNVSSRRHW-QGZVFWFLSA-N
MW369.51 g/mol
LogP3.23
Rot. Bonds4

About (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone

(1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone (PubChem CID 95896712) has the molecular formula C22H31N3O2 and a molecular weight of 369.51 g/mol. Its IUPAC name is (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone.

Molecular Properties

Compound Name(1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
PubChem CID95896712
Molecular FormulaC22H31N3O2
Molecular Weight369.51 g/mol
Exact Mass369.24
IUPAC Name(1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
SMILESCCn1ccc2cc(C(=O)N3CCC([C@@H](C)N4CCOCC4)CC3)ccc21
InChIInChI=1S/C22H31N3O2/c1-3-23-9-8-19-16-20(4-5-21(19)23)22(26)25-10-6-18(7-11-25)17(2)24-12-14-27-15-13-24/h4-5,8-9,16-18H,3,6-7,10-15H2,1-2H3/t17-/m1/s1
InChIKeyKGXKNHNVSSRRHW-QGZVFWFLSA-N
XLogP3.23
TPSA37.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.51
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone 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

(1-methylbenzimidazol-5-yl)-[4-[(1S)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
CID 125169053
(1-ethyl-2,5-dimethylpyrrol-3-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
CID 95877164
(3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
CID 96578007
isoquinolin-3-yl-[4-[(1S)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
CID 95861198
(4-chloro-2-hydroxyphenyl)-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]methanone
CID 56904274
(1-ethylindol-5-yl)-[3-[(2R)-2-methylpiperidin-1-yl]azetidin-1-yl]methanone
CID 125155690
3-(1-ethylindol-5-yl)-1-morpholin-4-ylpropan-1-one
CID 71840841
(3S)-4-(cyclopropylmethyl)-1-(1-ethylindole-5-carbonyl)-3-propan-2-yl-1,4-diazepan-5-one
CID 95563767
1-benzofuran-5-yl-[4-[(1R)-1-(4-methylpiperazin-1-yl)ethyl]piperidin-1-yl]methanone
CID 97134600
2-methyl-5-[4-(1-morpholin-4-ylethyl)piperidine-1-carbonyl]-1H-pyridin-4-one
CID 56909455
(5-ethyl-1H-pyrazol-4-yl)-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]methanone
CID 118788925
1,3-benzodioxol-5-yl-[4-[(1S)-1-cyclopropylethyl]piperazin-1-yl]methanone
CID 129370589

Frequently Asked Questions

What is the IUPAC name of (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone?
The IUPAC name of (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone (CID 95896712) is (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone.
What is the SMILES notation for (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone?
The canonical SMILES for (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone is CCn1ccc2cc(C(=O)N3CCC([C@@H](C)N4CCOCC4)CC3)ccc21.
What is the InChIKey of (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone?
The InChIKey is KGXKNHNVSSRRHW-QGZVFWFLSA-N. The full InChI is InChI=1S/C22H31N3O2/c1-3-23-9-8-19-16-20(4-5-21(19)23)22(26)25-10-6-18(7-11-25)17(2)24-12-14-27-15-13-24/h4-5,8-9,16-18H,3,6-7,10-15H2,1-2H3/t17-/m1/s1.
What are the key properties of (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone?
(1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone has a molecular weight of 369.51 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone is sourced from PubChem (CID 95896712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).