2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide

C14H22N2O2 — CID 43424856

IUPAC2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide
SMILESCOc1ccc(C(C)(C)C)cc1NC(=O)C(C)N
InChIInChI=1S/C14H22N2O2/c1-9(15)13(17)16-11-8-10(14(2,3)4)6-7-12(11)18-5/h6-9H,15H2,1-5H3,(H,16,17)
InChIKeyNWZGELVWJQJGBI-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.28
Rot. Bonds3

About 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide

2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide (PubChem CID 43424856) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide.

Molecular Properties

Compound Name2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide
PubChem CID43424856
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide
SMILESCOc1ccc(C(C)(C)C)cc1NC(=O)C(C)N
InChIInChI=1S/C14H22N2O2/c1-9(15)13(17)16-11-8-10(14(2,3)4)6-7-12(11)18-5/h6-9H,15H2,1-5H3,(H,16,17)
InChIKeyNWZGELVWJQJGBI-UHFFFAOYSA-N
XLogP2.28
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide 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

(2R)-2-amino-N-(5-tert-butyl-2-methoxyphenyl)-3,3-dimethylbutanamide
CID 103928652
(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
CID 22690513
2-amino-N-(5-tert-butyl-2-methoxyphenyl)hexanamide
CID 60852777
(2S)-2-amino-N-(5-bromo-2-methoxyphenyl)propanamide;hydrochloride
CID 119292528
(2S)-2-amino-N-(5-chloro-2-methoxyphenyl)propanamide;hydrochloride
CID 119262144
N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
CID 119266368
2-(aminomethyl)-N-(5-tert-butyl-2-methoxyphenyl)pentanamide
CID 65225620
(2S)-N-(5-tert-butyl-2-methoxyphenyl)-2-(4-chlorophenyl)-3-methylbutanamide
CID 7935933
N-(5-tert-butyl-2-methoxyphenyl)-4-propan-2-ylbenzamide
CID 7935956
N-(5-tert-butyl-2-methoxyphenyl)-2-methyl-2-(methylamino)propanamide
CID 62836730
N-(5-tert-butyl-2-methoxyphenyl)-1-cyanoformamide
CID 115171825
N-(5-tert-butyl-2-methoxyphenyl)-2-methoxyacetamide
CID 24657024

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide?
The IUPAC name of 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide (CID 43424856) is 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide.
What is the SMILES notation for 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide?
The canonical SMILES for 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide is COc1ccc(C(C)(C)C)cc1NC(=O)C(C)N.
What is the InChIKey of 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide?
The InChIKey is NWZGELVWJQJGBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-9(15)13(17)16-11-8-10(14(2,3)4)6-7-12(11)18-5/h6-9H,15H2,1-5H3,(H,16,17).
What are the key properties of 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide?
2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide has a molecular weight of 250.34 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide is sourced from PubChem (CID 43424856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).