2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide

C16H24N2O3 — CID 62337489

IUPAC2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide
SMILESCCOc1cccc(OCCC(C)(NC2CC2)C(N)=O)c1
InChIInChI=1S/C16H24N2O3/c1-3-20-13-5-4-6-14(11-13)21-10-9-16(2,15(17)19)18-12-7-8-12/h4-6,11-12,18H,3,7-10H2,1-2H3,(H2,17,19)
InChIKeyALPJICXJUDPANK-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.85
Rot. Bonds9

About 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide

2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide (PubChem CID 62337489) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide
PubChem CID62337489
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide
SMILESCCOc1cccc(OCCC(C)(NC2CC2)C(N)=O)c1
InChIInChI=1S/C16H24N2O3/c1-3-20-13-5-4-6-14(11-13)21-10-9-16(2,15(17)19)18-12-7-8-12/h4-6,11-12,18H,3,7-10H2,1-2H3,(H2,17,19)
InChIKeyALPJICXJUDPANK-UHFFFAOYSA-N
XLogP1.85
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide 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-amino-4-(3-ethoxyphenoxy)-2-methylbutanamide
CID 62336178
5-(3-ethoxyphenoxy)-2-(ethylamino)-2-methylpentanamide
CID 62337288
ethyl 2-amino-4-(3-ethoxyphenoxy)-2-methylbutanoate
CID 62337690
methyl 4-(3-ethoxyphenoxy)-2-(ethylamino)-2-methylbutanoate
CID 62336363
2-(cyclopropylamino)-3-[3-(methoxymethyl)phenoxy]-2-methylpropanamide
CID 63984624
methyl 2-amino-5-(3-ethoxyphenoxy)-2-methylpentanoate
CID 62336916
1-cyclopropyl-3-[2-(3-ethoxyphenoxy)ethyl]urea
CID 112972938
methyl 2-(cyclopropylamino)-3-(3-ethoxyphenoxy)propanoate
CID 62336177
2-(cyclopentylamino)-2-(4-ethoxyphenyl)propanamide
CID 60999099
4-(3-ethoxyphenoxy)-2-methyl-2-(methylamino)pentanamide
CID 64719136
2-(cyclopropylamino)-4-(3,5-difluorophenoxy)-2-methylbutanoic acid
CID 62785439
2-(cyclopropylamino)-3-(2,6-difluorophenoxy)-2-methylpropanamide
CID 81269914

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide?
The IUPAC name of 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide (CID 62337489) is 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide.
What is the SMILES notation for 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide?
The canonical SMILES for 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide is CCOc1cccc(OCCC(C)(NC2CC2)C(N)=O)c1.
What is the InChIKey of 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide?
The InChIKey is ALPJICXJUDPANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-3-20-13-5-4-6-14(11-13)21-10-9-16(2,15(17)19)18-12-7-8-12/h4-6,11-12,18H,3,7-10H2,1-2H3,(H2,17,19).
What are the key properties of 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide?
2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide has a molecular weight of 292.38 g/mol, XLogP of 1.85, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide is sourced from PubChem (CID 62337489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).