(2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide

C17H22N4O2 — CID 97336922

IUPAC(2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide
SMILESCn1ccnc1CNC(=O)N1CCO[C@H](Cc2ccccc2)C1
InChIInChI=1S/C17H22N4O2/c1-20-8-7-18-16(20)12-19-17(22)21-9-10-23-15(13-21)11-14-5-3-2-4-6-14/h2-8,15H,9-13H2,1H3,(H,19,22)/t15-/m1/s1
InChIKeyROWLIORIUAFNMN-OAHLLOKOSA-N
MW314.39 g/mol
LogP1.57
Rot. Bonds4

About (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide

(2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide (PubChem CID 97336922) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide
PubChem CID97336922
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name(2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide
SMILESCn1ccnc1CNC(=O)N1CCO[C@H](Cc2ccccc2)C1
InChIInChI=1S/C17H22N4O2/c1-20-8-7-18-16(20)12-19-17(22)21-9-10-23-15(13-21)11-14-5-3-2-4-6-14/h2-8,15H,9-13H2,1H3,(H,19,22)/t15-/m1/s1
InChIKeyROWLIORIUAFNMN-OAHLLOKOSA-N
XLogP1.57
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide 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-benzyl-N-[(2-methylpyrazol-3-yl)methyl]morpholine-4-carboxamide
CID 75445414
4-[[1-(2-phenylethyl)imidazol-2-yl]methylcarbamoyl]morpholine-2-carboxylic acid
CID 146133770
2-benzyl-N-(2-methyl-3-pyrazol-1-ylpropyl)morpholine-4-carboxamide
CID 75445416
(2S)-2-benzyl-N-[(2R)-2-methyl-3-pyrazol-1-ylpropyl]morpholine-4-carboxamide
CID 97336903
(2S)-2-(3,4-difluorophenyl)-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide
CID 99773840
2-benzyl-N-[(3-cyanophenyl)methyl]morpholine-4-carboxamide
CID 84596545
2-benzyl-N-(3-fluoropropyl)morpholine-4-carboxamide
CID 84596460
2-benzyl-N-(1-cyclopropylethyl)morpholine-4-carboxamide
CID 75445413
(2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide
CID 97337265
(2R)-2-benzyl-N-[[(3R)-1-ethylpiperidin-3-yl]methyl]morpholine-4-carboxamide
CID 97337261
(2R)-2-benzyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine-4-carboxamide
CID 97336828
[2-[(4-chlorophenyl)methyl]morpholin-4-yl]-(1-methylimidazol-2-yl)methanone
CID 102604353

Frequently Asked Questions

What is the IUPAC name of (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide?
The IUPAC name of (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide (CID 97336922) is (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide.
What is the SMILES notation for (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide?
The canonical SMILES for (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide is Cn1ccnc1CNC(=O)N1CCO[C@H](Cc2ccccc2)C1.
What is the InChIKey of (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide?
The InChIKey is ROWLIORIUAFNMN-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-20-8-7-18-16(20)12-19-17(22)21-9-10-23-15(13-21)11-14-5-3-2-4-6-14/h2-8,15H,9-13H2,1H3,(H,19,22)/t15-/m1/s1.
What are the key properties of (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide?
(2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide has a molecular weight of 314.39 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide is sourced from PubChem (CID 97336922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).