butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate

C25H43N3O3 — CID 166467522

IUPACbutane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
SMILESCC.CCCC.CN(C)CCc1cn(C(=O)OCCN2CCOCC2)c2ccccc12
InChIInChI=1S/C19H27N3O3.C4H10.C2H6/c1-20(2)8-7-16-15-22(18-6-4-3-5-17(16)18)19(23)25-14-11-21-9-12-24-13-10-21;1-3-4-2;1-2/h3-6,15H,7-14H2,1-2H3;3-4H2,1-2H3;1-2H3
InChIKeySKJAMDUCVXNDDR-UHFFFAOYSA-N
MW433.64 g/mol
LogP4.89
Rot. Bonds7

About butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate

butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate (PubChem CID 166467522) has the molecular formula C25H43N3O3 and a molecular weight of 433.64 g/mol. Its IUPAC name is butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate.

Molecular Properties

Compound Namebutane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
PubChem CID166467522
Molecular FormulaC25H43N3O3
Molecular Weight433.64 g/mol
Exact Mass433.33
IUPAC Namebutane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
SMILESCC.CCCC.CN(C)CCc1cn(C(=O)OCCN2CCOCC2)c2ccccc12
InChIInChI=1S/C19H27N3O3.C4H10.C2H6/c1-20(2)8-7-16-15-22(18-6-4-3-5-17(16)18)19(23)25-14-11-21-9-12-24-13-10-21;1-3-4-2;1-2/h3-6,15H,7-14H2,1-2H3;3-4H2,1-2H3;1-2H3
InChIKeySKJAMDUCVXNDDR-UHFFFAOYSA-N
XLogP4.89
TPSA46.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.64
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate 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

2-(2-oxa-5-azaspiro[3.5]nonan-5-yl)ethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
CID 166467537
oxane-4-carbonyloxymethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
CID 166467234
oxan-4-yloxycarbonyloxymethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
CID 166467776
2-methylpropanoyloxymethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
CID 166467171
(1-methylazetidine-3-carbonyl)oxymethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
CID 166467441
6-[[3-[2-(dimethylamino)ethyl]indole-1-carbonyl]oxymethoxy]-6-oxohexanoic acid
CID 166467624
1-[3-[2-(dimethylamino)ethyl]indol-1-yl]hexadecan-1-one
CID 166138506
1-[3-[2-(dimethylamino)ethyl]indol-1-yl]octadecan-1-one
CID 166138351
2-(dimethylamino)-1-[3-[2-(dimethylamino)ethyl]indol-1-yl]ethanone;hydrochloride
CID 166467543
propan-2-yloxycarbonyl 3-[2-(dimethylamino)ethyl]indole-1-carboperoxoate
CID 166467483
2-methoxyethyl 3-[2-(dimethylamino)ethyl]-6-methoxyindole-1-carboxylate
CID 168931038
(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxycarbonyloxymethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate
CID 166467519

Frequently Asked Questions

What is the IUPAC name of butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate?
The IUPAC name of butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate (CID 166467522) is butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate.
What is the SMILES notation for butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate?
The canonical SMILES for butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate is CC.CCCC.CN(C)CCc1cn(C(=O)OCCN2CCOCC2)c2ccccc12.
What is the InChIKey of butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate?
The InChIKey is SKJAMDUCVXNDDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3.C4H10.C2H6/c1-20(2)8-7-16-15-22(18-6-4-3-5-17(16)18)19(23)25-14-11-21-9-12-24-13-10-21;1-3-4-2;1-2/h3-6,15H,7-14H2,1-2H3;3-4H2,1-2H3;1-2H3.
What are the key properties of butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate?
butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate has a molecular weight of 433.64 g/mol, XLogP of 4.89, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for butane;ethane;2-morpholin-4-ylethyl 3-[2-(dimethylamino)ethyl]indole-1-carboxylate is sourced from PubChem (CID 166467522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).