(2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide

C22H32N2O2 — CID 97153061

IUPAC(2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc([C@H](C(=O)NCC2(O)C3CC4CC(C3)CC2C4)N(C)C)cc1
InChIInChI=1S/C22H32N2O2/c1-14-4-6-17(7-5-14)20(24(2)3)21(25)23-13-22(26)18-9-15-8-16(11-18)12-19(22)10-15/h4-7,15-16,18-20,26H,8-13H2,1-3H3,(H,23,25)/t15?,16?,18?,19?,20-,22?/m1/s1
InChIKeyXSCJASZHRADVJL-KAUDZBRASA-N
MW356.51 g/mol
LogP2.90
Rot. Bonds5

About (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide

(2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide (PubChem CID 97153061) has the molecular formula C22H32N2O2 and a molecular weight of 356.51 g/mol. Its IUPAC name is (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name(2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide
PubChem CID97153061
Molecular FormulaC22H32N2O2
Molecular Weight356.51 g/mol
Exact Mass356.25
IUPAC Name(2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc([C@H](C(=O)NCC2(O)C3CC4CC(C3)CC2C4)N(C)C)cc1
InChIInChI=1S/C22H32N2O2/c1-14-4-6-17(7-5-14)20(24(2)3)21(25)23-13-22(26)18-9-15-8-16(11-18)12-19(22)10-15/h4-7,15-16,18-20,26H,8-13H2,1-3H3,(H,23,25)/t15?,16?,18?,19?,20-,22?/m1/s1
InChIKeyXSCJASZHRADVJL-KAUDZBRASA-N
XLogP2.90
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.51
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide 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-(dimethylamino)-N-(3-hydroxypropyl)-2-(4-methylphenyl)acetamide
CID 72902135
2-(dimethylamino)-N-[[4-(dimethylamino)-1-ethylpiperidin-4-yl]methyl]-2-(4-methylphenyl)acetamide
CID 72845654
(2S)-2-(dimethylamino)-N-[[4-(dimethylamino)-1-ethylpiperidin-4-yl]methyl]-2-(4-methylphenyl)acetamide
CID 97110124
4-[[(2R)-2-(dimethylamino)-2-(4-methylphenyl)acetyl]amino]butanoic acid
CID 97269726
(2R)-2-(dimethylamino)-2-(4-methylphenyl)-N-(2-pyrrol-1-ylethyl)acetamide
CID 97126387
2-(dimethylamino)-N-[(2,6-dimethyl-4-pyridinyl)methyl]-2-(4-methylphenyl)acetamide
CID 72873453
(2S)-2-(dimethylamino)-N-[(1-hydroxycyclohexyl)methyl]-2-(3-methylphenyl)acetamide
CID 97203958
(2R)-2-(dimethylamino)-N-[2-(4,6-dimethylpyrimidin-2-yl)ethyl]-2-(4-methylphenyl)acetamide
CID 97200456
(2R)-2-(dimethylamino)-2-(4-methylphenyl)-N-[2-(2-oxopyrrolidin-1-yl)ethyl]acetamide
CID 97202624
(2R)-2-(4-chlorophenyl)-2-(dimethylamino)-N-[(3-methyloxetan-3-yl)methyl]acetamide
CID 51599913
(2S)-2-(dimethylamino)-N-[[1-(dimethylamino)cycloheptyl]methyl]-2-(4-fluorophenyl)acetamide
CID 97190654
1-[[(2S)-2-(dimethylamino)-2-(4-methylphenyl)acetyl]amino]cyclopentane-1-carboxamide
CID 97145403

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide (CID 97153061) is (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide is Cc1ccc([C@H](C(=O)NCC2(O)C3CC4CC(C3)CC2C4)N(C)C)cc1.
What is the InChIKey of (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide?
The InChIKey is XSCJASZHRADVJL-KAUDZBRASA-N. The full InChI is InChI=1S/C22H32N2O2/c1-14-4-6-17(7-5-14)20(24(2)3)21(25)23-13-22(26)18-9-15-8-16(11-18)12-19(22)10-15/h4-7,15-16,18-20,26H,8-13H2,1-3H3,(H,23,25)/t15?,16?,18?,19?,20-,22?/m1/s1.
What are the key properties of (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide?
(2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide has a molecular weight of 356.51 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(dimethylamino)-N-[(2-hydroxy-2-adamantyl)methyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 97153061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).