2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide

C19H24N2O2 — CID 94806000

IUPAC2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc([C@@H](O)CNC(=O)CN(C)Cc2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-15-8-10-17(11-9-15)18(22)12-20-19(23)14-21(2)13-16-6-4-3-5-7-16/h3-11,18,22H,12-14H2,1-2H3,(H,20,23)/t18-/m0/s1
InChIKeyYOPBMTNWOODZEV-SFHVURJKSA-N
MW312.41 g/mol
LogP2.28
Rot. Bonds7

About 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide

2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide (PubChem CID 94806000) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide
PubChem CID94806000
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc([C@@H](O)CNC(=O)CN(C)Cc2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-15-8-10-17(11-9-15)18(22)12-20-19(23)14-21(2)13-16-6-4-3-5-7-16/h3-11,18,22H,12-14H2,1-2H3,(H,20,23)/t18-/m0/s1
InChIKeyYOPBMTNWOODZEV-SFHVURJKSA-N
XLogP2.28
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[benzyl(methyl)amino]-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]acetamide
CID 110908744
3-[methyl-[(4-methylphenyl)methyl]amino]-1-phenylpropan-1-ol
CID 62612269
2-[benzyl(methyl)amino]-N-(2-phenylethyl)acetamide
CID 54808729
2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]-N-(2-phenylethyl)acetamide
CID 9028707
2-[benzyl(methyl)amino]-N-propan-2-ylacetamide
CID 54808895
2-[benzyl(methyl)amino]-N-(1-phenylethyl)acetamide
CID 18078396
2-[benzyl(methyl)amino]-N-prop-2-enylacetamide
CID 51072751
2-[benzyl(methyl)amino]-N-(3-phenylpropyl)acetamide
CID 78787240
N-[2-[[2-(4-chlorophenyl)-2-hydroxyethyl]amino]-2-oxoethyl]-N-methylbenzamide
CID 110885729
2-[benzyl(methyl)amino]-N-(4-hydroxy-2,2-dimethylpentyl)acetamide
CID 111480691
N-(2-hydroxy-2-phenylethyl)-4-methylbenzamide
CID 2812769
2-[(3-chlorophenyl)methyl-methylamino]-N-[2-(dimethylamino)-2-phenylethyl]acetamide
CID 112800289

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide (CID 94806000) is 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide is Cc1ccc([C@@H](O)CNC(=O)CN(C)Cc2ccccc2)cc1.
What is the InChIKey of 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide?
The InChIKey is YOPBMTNWOODZEV-SFHVURJKSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15-8-10-17(11-9-15)18(22)12-20-19(23)14-21(2)13-16-6-4-3-5-7-16/h3-11,18,22H,12-14H2,1-2H3,(H,20,23)/t18-/m0/s1.
What are the key properties of 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide?
2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide has a molecular weight of 312.41 g/mol, XLogP of 2.28, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(methyl)amino]-N-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 94806000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).