N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride

C15H25ClN2O2 — CID 120607557

IUPACN-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride
SMILESCCCCC(CC)C(=O)Nc1cc(OC)ccc1N.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-4-6-7-11(5-2)15(18)17-14-10-12(19-3)8-9-13(14)16;/h8-11H,4-7,16H2,1-3H3,(H,17,18);1H
InChIKeyCZAHOKSHHBTTCA-UHFFFAOYSA-N
MW300.83 g/mol
LogP3.85
Rot. Bonds7

About N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride

N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride (PubChem CID 120607557) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride
PubChem CID120607557
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC NameN-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride
SMILESCCCCC(CC)C(=O)Nc1cc(OC)ccc1N.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-4-6-7-11(5-2)15(18)17-14-10-12(19-3)8-9-13(14)16;/h8-11H,4-7,16H2,1-3H3,(H,17,18);1H
InChIKeyCZAHOKSHHBTTCA-UHFFFAOYSA-N
XLogP3.85
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.83
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride 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-5-chlorophenyl)-2-ethylhexanamide
CID 43125435
N-(4-amino-2,5-dimethoxyphenyl)-2-ethylhexanamide
CID 139792961
[4-amino-3-(2-ethylhexanoylamino)phenyl] imidazole-1-carboxylate
CID 68896972
N-(2-amino-5-methoxyphenyl)-2-(2-ethoxyethoxy)propanamide
CID 119421324
N-(2-amino-5-methoxyphenyl)-2-(3-methylbutoxy)propanamide
CID 119421306
N-(2-amino-4-bromophenyl)-2-ethylhexanamide
CID 43130493
2-ethyl-N-(6-methoxy-1,3-benzothiazol-2-yl)hexanamide
CID 4036340
N-(4-amino-2-bromophenyl)-2-ethylhexanamide
CID 43549454
N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride
CID 119421240
2-amino-N-(4-methoxy-2-methylphenyl)hexanamide
CID 62871713
(2S)-N-(2-amino-4-methoxyphenyl)-2-methylbutanamide
CID 40788880
methyl 2-(2-ethylhexanoylamino)benzoate
CID 4589929

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride?
The IUPAC name of N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride (CID 120607557) is N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride.
What is the SMILES notation for N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride?
The canonical SMILES for N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride is CCCCC(CC)C(=O)Nc1cc(OC)ccc1N.Cl.
What is the InChIKey of N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride?
The InChIKey is CZAHOKSHHBTTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-4-6-7-11(5-2)15(18)17-14-10-12(19-3)8-9-13(14)16;/h8-11H,4-7,16H2,1-3H3,(H,17,18);1H.
What are the key properties of N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride?
N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 3.85, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-methoxyphenyl)-2-ethylhexanamide;hydrochloride is sourced from PubChem (CID 120607557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).