4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine

C17H20N4O — CID 155983471

IUPAC4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine
SMILESCc1cnc(C2CN(Cc3ccc4[nH]ccc4c3)CCO2)[nH]1
InChIInChI=1S/C17H20N4O/c1-12-9-19-17(20-12)16-11-21(6-7-22-16)10-13-2-3-15-14(8-13)4-5-18-15/h2-5,8-9,16,18H,6-7,10-11H2,1H3,(H,19,20)
InChIKeyIESNPHXLTCOQKV-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.77
Rot. Bonds3

About 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine

4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine (PubChem CID 155983471) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine.

Molecular Properties

Compound Name4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine
PubChem CID155983471
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine
SMILESCc1cnc(C2CN(Cc3ccc4[nH]ccc4c3)CCO2)[nH]1
InChIInChI=1S/C17H20N4O/c1-12-9-19-17(20-12)16-11-21(6-7-22-16)10-13-2-3-15-14(8-13)4-5-18-15/h2-5,8-9,16,18H,6-7,10-11H2,1H3,(H,19,20)
InChIKeyIESNPHXLTCOQKV-UHFFFAOYSA-N
XLogP2.77
TPSA56.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine 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

6-[4-(1H-indol-5-ylmethyl)morpholin-2-yl]-N,2-dimethylpyrimidin-4-amine
CID 110271900
3-[[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methyl]benzoic acid
CID 124969004
(2R)-4-(1H-imidazol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine
CID 125017640
(2S)-4-[(2,5-difluorophenyl)methyl]-2-(5-methyl-1H-imidazol-2-yl)morpholine
CID 124963019
2-(5-methyl-1H-imidazol-2-yl)-4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 110104978
(2R)-2-(5-methyl-1H-imidazol-2-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
CID 124960812
(2S)-2-(5-methyl-1H-imidazol-2-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
CID 124960811
(2R)-2-(5-methyl-1H-imidazol-2-yl)-4-(3-phenylpropyl)morpholine
CID 124987098
2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine
CID 110104945
N,N-dimethyl-1-[2-[4-(quinolin-6-ylmethyl)morpholin-2-yl]-1H-imidazol-5-yl]methanamine
CID 110117068
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone
CID 124995684
5-[(4-methylpiperidin-1-yl)methyl]-1H-indole
CID 90949338

Frequently Asked Questions

What is the IUPAC name of 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine?
The IUPAC name of 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine (CID 155983471) is 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine.
What is the SMILES notation for 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine?
The canonical SMILES for 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine is Cc1cnc(C2CN(Cc3ccc4[nH]ccc4c3)CCO2)[nH]1.
What is the InChIKey of 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine?
The InChIKey is IESNPHXLTCOQKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-12-9-19-17(20-12)16-11-21(6-7-22-16)10-13-2-3-15-14(8-13)4-5-18-15/h2-5,8-9,16,18H,6-7,10-11H2,1H3,(H,19,20).
What are the key properties of 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine?
4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine has a molecular weight of 296.37 g/mol, XLogP of 2.77, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine is sourced from PubChem (CID 155983471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).