4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine

C26H34N4O — CID 10295535

IUPAC4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine
SMILESCc1c(N2CCOCC2)cccc1N1CCN(CCCc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C26H34N4O/c1-21-25(9-4-10-26(21)30-16-18-31-19-17-30)29-14-12-28(13-15-29)11-5-6-22-20-27-24-8-3-2-7-23(22)24/h2-4,7-10,20,27H,5-6,11-19H2,1H3
InChIKeyQRYDJKIUTYSRPY-UHFFFAOYSA-N
MW418.59 g/mol
LogP4.07
Rot. Bonds6

About 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine

4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine (PubChem CID 10295535) has the molecular formula C26H34N4O and a molecular weight of 418.59 g/mol. Its IUPAC name is 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine.

Molecular Properties

Compound Name4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine
PubChem CID10295535
Molecular FormulaC26H34N4O
Molecular Weight418.59 g/mol
Exact Mass418.27
IUPAC Name4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine
SMILESCc1c(N2CCOCC2)cccc1N1CCN(CCCc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C26H34N4O/c1-21-25(9-4-10-26(21)30-16-18-31-19-17-30)29-14-12-28(13-15-29)11-5-6-22-20-27-24-8-3-2-7-23(22)24/h2-4,7-10,20,27H,5-6,11-19H2,1H3
InChIKeyQRYDJKIUTYSRPY-UHFFFAOYSA-N
XLogP4.07
TPSA34.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.59
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine with MolForge

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Related Compounds

4-[4-[2-(1H-indol-3-yl)ethyl]piperazin-1-yl]-3-morpholin-4-ylphenol
CID 155776079
8-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2,2-dimethyl-4H-1,4-benzoxazin-3-one
CID 11553516
3-[2-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]phenoxy]-N,N-dimethylaniline
CID 10226137
5-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-1,2,3,4-tetrahydroquinoline;hydrochloride
CID 11567753
3-[3-[4-(2-phenylethyl)piperazin-1-yl]propyl]-1H-indole
CID 19610450
3-[3-[4-[2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)phenyl]piperazin-1-yl]propyl]-1H-indole
CID 10276872
3-[4-[4-(2-phenoxyphenyl)piperazin-1-yl]butyl]-1H-indole
CID 10113204
3-[2-[4-[4-(1H-indol-3-yl)butyl]piperazin-1-yl]phenoxy]-N,N-dimethylaniline
CID 10298788
N'-[2-(1H-indol-3-yl)ethyl]-N-(3-morpholin-4-ylpropyl)oxamide
CID 44902823
4-[3-[2-[4-[2-(3-morpholin-4-ylpropyl)phenyl]piperazin-1-yl]phenyl]propyl]morpholine
CID 170869798
4-[4-[2-(1H-indol-3-yl)ethyl]piperazin-1-yl]-2,1,3-benzothiadiazole
CID 141091044
3-(4-piperazin-1-ylbutyl)-1H-indole
CID 95465204

Frequently Asked Questions

What is the IUPAC name of 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine?
The IUPAC name of 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine (CID 10295535) is 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine.
What is the SMILES notation for 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine?
The canonical SMILES for 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine is Cc1c(N2CCOCC2)cccc1N1CCN(CCCc2c[nH]c3ccccc23)CC1.
What is the InChIKey of 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine?
The InChIKey is QRYDJKIUTYSRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N4O/c1-21-25(9-4-10-26(21)30-16-18-31-19-17-30)29-14-12-28(13-15-29)11-5-6-22-20-27-24-8-3-2-7-23(22)24/h2-4,7-10,20,27H,5-6,11-19H2,1H3.
What are the key properties of 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine?
4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine has a molecular weight of 418.59 g/mol, XLogP of 4.07, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]-2-methylphenyl]morpholine is sourced from PubChem (CID 10295535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).