(3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine

C17H23N3O — CID 56775935

IUPAC(3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine
SMILESCc1ccc(-c2cnc([C@@H]3COCCN3C(C)C)[nH]2)cc1
InChIInChI=1S/C17H23N3O/c1-12(2)20-8-9-21-11-16(20)17-18-10-15(19-17)14-6-4-13(3)5-7-14/h4-7,10,12,16H,8-9,11H2,1-3H3,(H,18,19)/t16-/m0/s1
InChIKeyCJSVOIYQBCPQJC-INIZCTEOSA-N
MW285.39 g/mol
LogP3.17
Rot. Bonds3

About (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine

(3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine (PubChem CID 56775935) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine.

Molecular Properties

Compound Name(3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine
PubChem CID56775935
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name(3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine
SMILESCc1ccc(-c2cnc([C@@H]3COCCN3C(C)C)[nH]2)cc1
InChIInChI=1S/C17H23N3O/c1-12(2)20-8-9-21-11-16(20)17-18-10-15(19-17)14-6-4-13(3)5-7-14/h4-7,10,12,16H,8-9,11H2,1-3H3,(H,18,19)/t16-/m0/s1
InChIKeyCJSVOIYQBCPQJC-INIZCTEOSA-N
XLogP3.17
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine?
The IUPAC name of (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine (CID 56775935) is (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine.
What is the SMILES notation for (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine?
The canonical SMILES for (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine is Cc1ccc(-c2cnc([C@@H]3COCCN3C(C)C)[nH]2)cc1.
What is the InChIKey of (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine?
The InChIKey is CJSVOIYQBCPQJC-INIZCTEOSA-N. The full InChI is InChI=1S/C17H23N3O/c1-12(2)20-8-9-21-11-16(20)17-18-10-15(19-17)14-6-4-13(3)5-7-14/h4-7,10,12,16H,8-9,11H2,1-3H3,(H,18,19)/t16-/m0/s1.
What are the key properties of (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine?
(3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine has a molecular weight of 285.39 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-4-propan-2-ylmorpholine is sourced from PubChem (CID 56775935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).