(2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide

C20H26N2O2 — CID 95302590

IUPAC(2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide
SMILESCC(C)(C)OCc1cccc(CN[C@H](C(N)=O)c2ccccc2)c1
InChIInChI=1S/C20H26N2O2/c1-20(2,3)24-14-16-9-7-8-15(12-16)13-22-18(19(21)23)17-10-5-4-6-11-17/h4-12,18,22H,13-14H2,1-3H3,(H2,21,23)/t18-/m0/s1
InChIKeyLMUYVXSQUOVPFG-SFHVURJKSA-N
MW326.44 g/mol
LogP3.32
Rot. Bonds7

About (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide

(2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide (PubChem CID 95302590) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide
PubChem CID95302590
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name(2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide
SMILESCC(C)(C)OCc1cccc(CN[C@H](C(N)=O)c2ccccc2)c1
InChIInChI=1S/C20H26N2O2/c1-20(2,3)24-14-16-9-7-8-15(12-16)13-22-18(19(21)23)17-10-5-4-6-11-17/h4-12,18,22H,13-14H2,1-3H3,(H2,21,23)/t18-/m0/s1
InChIKeyLMUYVXSQUOVPFG-SFHVURJKSA-N
XLogP3.32
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide 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

methyl (2S)-2-[[3-[[[(1S)-2-methoxy-2-oxo-1-phenylethyl]amino]methyl]phenyl]methylamino]-2-phenylacetate
CID 24762008
2-(benzylamino)-2-(3-methoxyphenyl)acetamide
CID 10849658
(2S)-2-[[4-[(3-chlorophenyl)methoxy]phenyl]methylamino]-2-phenylacetamide
CID 23625504
2-[[4-(ethoxymethyl)phenyl]methylamino]-2-phenylacetamide
CID 56811841
(2R)-2-(benzylamino)-2-(4-methylphenyl)acetamide
CID 10824853
2-[[4-[(3-fluorophenyl)methylamino]phenyl]methylamino]-2-phenylacetamide;methanesulfonic acid
CID 87877252
2-(benzylamino)-2-[4-(difluoromethyl)phenyl]acetamide
CID 115524447
(2R)-2-phenyl-2-[(3-propylphenyl)methylamino]acetic acid
CID 120510352
(2S)-2-phenyl-2-[(3-propylphenyl)methylamino]acetic acid
CID 120511809
methyl 2-(benzylamino)-2-phenylacetate;hydrochloride
CID 12677532
2-(benzylamino)-2-[3,5-bis(trifluoromethyl)phenyl]acetamide
CID 113268835
2-(methylamino)-N-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]acetamide;hydrochloride
CID 120704236

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide?
The IUPAC name of (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide (CID 95302590) is (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide.
What is the SMILES notation for (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide?
The canonical SMILES for (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide is CC(C)(C)OCc1cccc(CN[C@H](C(N)=O)c2ccccc2)c1.
What is the InChIKey of (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide?
The InChIKey is LMUYVXSQUOVPFG-SFHVURJKSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-20(2,3)24-14-16-9-7-8-15(12-16)13-22-18(19(21)23)17-10-5-4-6-11-17/h4-12,18,22H,13-14H2,1-3H3,(H2,21,23)/t18-/m0/s1.
What are the key properties of (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide?
(2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide has a molecular weight of 326.44 g/mol, XLogP of 3.32, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methylamino]-2-phenylacetamide is sourced from PubChem (CID 95302590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).