(2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine

C18H23N3O — CID 95123859

IUPAC(2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine
SMILESCC(C)=Cc1c(-c2ccccc2)ncn1C[C@@H]1CNCCO1
InChIInChI=1S/C18H23N3O/c1-14(2)10-17-18(15-6-4-3-5-7-15)20-13-21(17)12-16-11-19-8-9-22-16/h3-7,10,13,16,19H,8-9,11-12H2,1-2H3/t16-/m0/s1
InChIKeyPZIFHBDGWGMLDM-INIZCTEOSA-N
MW297.40 g/mol
LogP2.96
Rot. Bonds4

About (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine

(2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine (PubChem CID 95123859) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine.

Molecular Properties

Compound Name(2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine
PubChem CID95123859
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC Name(2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine
SMILESCC(C)=Cc1c(-c2ccccc2)ncn1C[C@@H]1CNCCO1
InChIInChI=1S/C18H23N3O/c1-14(2)10-17-18(15-6-4-3-5-7-15)20-13-21(17)12-16-11-19-8-9-22-16/h3-7,10,13,16,19H,8-9,11-12H2,1-2H3/t16-/m0/s1
InChIKeyPZIFHBDGWGMLDM-INIZCTEOSA-N
XLogP2.96
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]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

2-[[5-(1H-indol-2-yl)-4-phenylimidazol-1-yl]methyl]morpholine;dihydrochloride
CID 154890014
1-[2-[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]ethyl]piperidine-3-carboxamide
CID 50960859
N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide
CID 95135000
(1R)-2-[(2S)-morpholin-2-yl]-1-phenylethanol
CID 91338656
2-morpholin-2-ylethanol;toluene
CID 118211589
2-[[(2S)-morpholin-2-yl]methyl]isoindole-1,3-dione
CID 6932395
2-morpholin-2-yl-1-(4-phenylphenyl)ethanone
CID 116586201
(2R)-2-[[2-(3-methyl-4-pyridinyl)-5-phenyl-1,2,4-triazol-3-yl]methyl]morpholine
CID 95224109
1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one
CID 80580840
2-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]morpholine
CID 63778262
(Z)-but-2-enedioic acid;3-(morpholin-2-ylmethyl)-1-phenylimidazo[4,5-b]pyridin-2-one
CID 86736079
2-[[2-(3-methyl-4-pyridinyl)-5-phenyl-1,2,4-triazol-3-yl]methyl]morpholine;hydrochloride
CID 171686957

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine?
The IUPAC name of (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine (CID 95123859) is (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine.
What is the SMILES notation for (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine?
The canonical SMILES for (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine is CC(C)=Cc1c(-c2ccccc2)ncn1C[C@@H]1CNCCO1.
What is the InChIKey of (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine?
The InChIKey is PZIFHBDGWGMLDM-INIZCTEOSA-N. The full InChI is InChI=1S/C18H23N3O/c1-14(2)10-17-18(15-6-4-3-5-7-15)20-13-21(17)12-16-11-19-8-9-22-16/h3-7,10,13,16,19H,8-9,11-12H2,1-2H3/t16-/m0/s1.
What are the key properties of (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine?
(2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine has a molecular weight of 297.40 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[[5-(2-methylprop-1-enyl)-4-phenylimidazol-1-yl]methyl]morpholine is sourced from PubChem (CID 95123859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).