2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide

C15H23N3O2 — CID 119526121

IUPAC2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide
SMILESCC(=O)NCC(=O)NCC(N)c1ccc(C(C)C)cc1
InChIInChI=1S/C15H23N3O2/c1-10(2)12-4-6-13(7-5-12)14(16)8-18-15(20)9-17-11(3)19/h4-7,10,14H,8-9,16H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyWMKJSRDAAALKGA-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.06
Rot. Bonds6

About 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide

2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide (PubChem CID 119526121) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide
PubChem CID119526121
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide
SMILESCC(=O)NCC(=O)NCC(N)c1ccc(C(C)C)cc1
InChIInChI=1S/C15H23N3O2/c1-10(2)12-4-6-13(7-5-12)14(16)8-18-15(20)9-17-11(3)19/h4-7,10,14H,8-9,16H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyWMKJSRDAAALKGA-UHFFFAOYSA-N
XLogP1.06
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]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

N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-(cyclohexylcarbamoylamino)acetamide
CID 119526973
2-acetamido-N-(4-propan-2-ylphenyl)acetamide
CID 110687041
3-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-3-phenylpropanamide
CID 119526217
2-acetamido-N-[2-[[2-methyl-1-(4-propan-2-ylphenyl)propyl]amino]-2-oxoethyl]acetamide
CID 60559744
7-amino-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]heptanamide
CID 122080402
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-(2-methylphenyl)acetamide
CID 119260530
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-propoxyacetamide
CID 119526031
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]pent-4-enamide;dihydrochloride
CID 119526644
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]hex-5-enamide;dihydrochloride
CID 119527050
2-acetyl-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]benzamide
CID 119525343
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-butoxyacetamide
CID 119525929
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-5-methoxypentanamide;hydrochloride
CID 119526500

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide?
The IUPAC name of 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide (CID 119526121) is 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide?
The canonical SMILES for 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide is CC(=O)NCC(=O)NCC(N)c1ccc(C(C)C)cc1.
What is the InChIKey of 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide?
The InChIKey is WMKJSRDAAALKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10(2)12-4-6-13(7-5-12)14(16)8-18-15(20)9-17-11(3)19/h4-7,10,14H,8-9,16H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide?
2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.06, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]acetamide is sourced from PubChem (CID 119526121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).