(4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane

C14H22N2O — CID 142384259

IUPAC(4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane
SMILESC.C[C@@]1(CCN)CC(=O)N1Cc1ccccc1
InChIInChI=1S/C13H18N2O.CH4/c1-13(7-8-14)9-12(16)15(13)10-11-5-3-2-4-6-11;/h2-6H,7-10,14H2,1H3;1H4/t13-;/m1./s1
InChIKeyIKBPGOMNGBWXFH-BTQNPOSSSA-N
MW234.34 g/mol
LogP2.16
Rot. Bonds4

About (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane

(4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane (PubChem CID 142384259) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane.

Molecular Properties

Compound Name(4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane
PubChem CID142384259
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane
SMILESC.C[C@@]1(CCN)CC(=O)N1Cc1ccccc1
InChIInChI=1S/C13H18N2O.CH4/c1-13(7-8-14)9-12(16)15(13)10-11-5-3-2-4-6-11;/h2-6H,7-10,14H2,1H3;1H4/t13-;/m1./s1
InChIKeyIKBPGOMNGBWXFH-BTQNPOSSSA-N
XLogP2.16
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane 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

3-benzyl-2,2-dimethylimidazolidin-4-one
CID 57433089
1-benzyl-2-methyl-5-oxopyrrolidine-2-carbonitrile
CID 117066612
1-benzyl-2,2-dimethyl-3H-quinolin-4-one
CID 139227185
3-benzyl-2,2-dipropylimidazolidin-4-one
CID 122605923
(2R)-1,2-dibenzyl-4-oxoazetidine-2-carboxylic acid
CID 86338341
(4R)-1-benzyl-4-hydroxy-4-methylpyrrolidin-2-one
CID 98042329
4-(2-aminoethyl)-3-[(3-fluorophenyl)methyl]-4-methyl-1,3-oxazolidin-2-one
CID 115064483
1-benzyl-5-hydroxy-5-propylpyrrolidin-2-one
CID 135039839
4-benzyl-2,2,7,7-tetramethyl-1,4-diazepan-5-one
CID 57087301
(3R)-1-benzyl-3-methyl-3-phenylpyrrolidine-2,5-dione
CID 102187715
1,10-bis(4-aminobutyl)-4,7,13,16-tetrabenzyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone
CID 46228486
1-benzyl-3-methoxyimino-5,5-dimethylpyrrolidin-2-one
CID 173032997

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane?
The IUPAC name of (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane (CID 142384259) is (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane.
What is the SMILES notation for (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane?
The canonical SMILES for (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane is C.C[C@@]1(CCN)CC(=O)N1Cc1ccccc1.
What is the InChIKey of (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane?
The InChIKey is IKBPGOMNGBWXFH-BTQNPOSSSA-N. The full InChI is InChI=1S/C13H18N2O.CH4/c1-13(7-8-14)9-12(16)15(13)10-11-5-3-2-4-6-11;/h2-6H,7-10,14H2,1H3;1H4/t13-;/m1./s1.
What are the key properties of (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane?
(4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane has a molecular weight of 234.34 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane is sourced from PubChem (CID 142384259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).