3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide

C20H28N2O2 — CID 167933899

IUPAC3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide
SMILESCC(C)C(N)C(C)(C)C(=O)NCC(O)c1ccc2ccccc2c1
InChIInChI=1S/C20H28N2O2/c1-13(2)18(21)20(3,4)19(24)22-12-17(23)16-10-9-14-7-5-6-8-15(14)11-16/h5-11,13,17-18,23H,12,21H2,1-4H3,(H,22,24)
InChIKeyVNOONDZRKNESNQ-UHFFFAOYSA-N
MW328.46 g/mol
LogP3.00
Rot. Bonds6

About 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide

3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide (PubChem CID 167933899) has the molecular formula C20H28N2O2 and a molecular weight of 328.46 g/mol. Its IUPAC name is 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide.

Molecular Properties

Compound Name3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide
PubChem CID167933899
Molecular FormulaC20H28N2O2
Molecular Weight328.46 g/mol
Exact Mass328.22
IUPAC Name3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide
SMILESCC(C)C(N)C(C)(C)C(=O)NCC(O)c1ccc2ccccc2c1
InChIInChI=1S/C20H28N2O2/c1-13(2)18(21)20(3,4)19(24)22-12-17(23)16-10-9-14-7-5-6-8-15(14)11-16/h5-11,13,17-18,23H,12,21H2,1-4H3,(H,22,24)
InChIKeyVNOONDZRKNESNQ-UHFFFAOYSA-N
XLogP3.00
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 53.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide 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

N-(2-hydroxy-2-naphthalen-2-ylethyl)-2-methylpropanamide
CID 111112159
(1R)-2-[[(2S)-3,3-dimethylbutan-2-yl]amino]-1-naphthalen-2-ylethanol
CID 124562243
2-(dimethylamino)-N-(2-hydroxy-2-naphthalen-2-ylethyl)-3-methylbutanamide
CID 111112176
2-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-3-methoxypropanamide
CID 120989475
1-[(2R)-2-hydroxy-2-naphthalen-2-ylethyl]-3-(2-methyl-2-pyrrolidin-1-ylpropyl)urea
CID 126435297
(2S)-2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]-3-methylbutan-1-ol
CID 79250265
2-(2,2-dimethylpropylamino)-1-naphthalen-2-ylethanol
CID 61167220
N-(2-hydroxy-2-naphthalen-2-ylethyl)-3-methoxypropanamide
CID 111112240
2-[[(2S)-2-hydroxy-2-naphthalen-2-ylethyl]amino]-2-methylpropane-1,3-diol
CID 124571352
(3R)-3-[[(2R)-2-hydroxy-2-naphthalen-2-ylethyl]amino]butanoic acid
CID 125470025
2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]-N-methylpropanamide
CID 61464613
N-[(2S)-2-hydroxy-2-naphthalen-2-ylethyl]-2-(4-methoxyphenyl)acetamide
CID 95618415

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide?
The IUPAC name of 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide (CID 167933899) is 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide.
What is the SMILES notation for 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide?
The canonical SMILES for 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide is CC(C)C(N)C(C)(C)C(=O)NCC(O)c1ccc2ccccc2c1.
What is the InChIKey of 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide?
The InChIKey is VNOONDZRKNESNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O2/c1-13(2)18(21)20(3,4)19(24)22-12-17(23)16-10-9-14-7-5-6-8-15(14)11-16/h5-11,13,17-18,23H,12,21H2,1-4H3,(H,22,24).
What are the key properties of 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide?
3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide has a molecular weight of 328.46 g/mol, XLogP of 3.00, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-hydroxy-2-naphthalen-2-ylethyl)-2,2,4-trimethylpentanamide is sourced from PubChem (CID 167933899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).