N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride

C19H25ClN2O4 — CID 119421240

IUPACN-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride
SMILESCCCCOc1ccc(C(=O)Nc2cc(OC)ccc2N)cc1OC.Cl
InChIInChI=1S/C19H24N2O4.ClH/c1-4-5-10-25-17-9-6-13(11-18(17)24-3)19(22)21-16-12-14(23-2)7-8-15(16)20;/h6-9,11-12H,4-5,10,20H2,1-3H3,(H,21,22);1H
InChIKeySYURVDVJGHNWCG-UHFFFAOYSA-N
MW380.87 g/mol
LogP4.14
Rot. Bonds8

About N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride

N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride (PubChem CID 119421240) has the molecular formula C19H25ClN2O4 and a molecular weight of 380.87 g/mol. Its IUPAC name is N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride
PubChem CID119421240
Molecular FormulaC19H25ClN2O4
Molecular Weight380.87 g/mol
Exact Mass380.15
IUPAC NameN-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride
SMILESCCCCOc1ccc(C(=O)Nc2cc(OC)ccc2N)cc1OC.Cl
InChIInChI=1S/C19H24N2O4.ClH/c1-4-5-10-25-17-9-6-13(11-18(17)24-3)19(22)21-16-12-14(23-2)7-8-15(16)20;/h6-9,11-12H,4-5,10,20H2,1-3H3,(H,21,22);1H
InChIKeySYURVDVJGHNWCG-UHFFFAOYSA-N
XLogP4.14
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.87
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;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-methoxyphenyl)-4-butoxy-3-ethoxybenzamide
CID 119421219
3-amino-N-(2-butoxy-5-methoxyphenyl)benzamide;hydrochloride
CID 119715062
4-(aminomethyl)-N-(2-butoxy-5-methoxyphenyl)benzamide;hydrochloride
CID 119284799
3-amino-N-(2,4-dimethoxyphenyl)-4-propoxybenzamide
CID 110499819
4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide
CID 26914609
N-(2-butoxy-5-methoxyphenyl)-3-methoxy-4-[2-oxo-2-(propan-2-ylamino)ethoxy]benzamide
CID 55777600
4-butoxy-3-methoxy-N-(2-propoxyphenyl)benzamide
CID 26897955
4-butoxy-3-methoxy-N-(2-methoxy-5-nitrophenyl)benzamide
CID 2213710
4-butoxy-N-(2,4-dichlorophenyl)-3-methoxybenzamide
CID 26115429
4-butoxy-N-(2-fluoro-4-methylphenyl)-3-methoxybenzamide
CID 26522911
3-benzamido-N-(2-butoxy-5-methoxyphenyl)-4-methylbenzamide
CID 55674446
4-butoxy-3-ethoxy-N-(4-methoxyphenyl)benzamide
CID 27228846

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride?
The IUPAC name of N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride (CID 119421240) is N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride.
What is the SMILES notation for N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride?
The canonical SMILES for N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride is CCCCOc1ccc(C(=O)Nc2cc(OC)ccc2N)cc1OC.Cl.
What is the InChIKey of N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride?
The InChIKey is SYURVDVJGHNWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4.ClH/c1-4-5-10-25-17-9-6-13(11-18(17)24-3)19(22)21-16-12-14(23-2)7-8-15(16)20;/h6-9,11-12H,4-5,10,20H2,1-3H3,(H,21,22);1H.
What are the key properties of N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride?
N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride has a molecular weight of 380.87 g/mol, XLogP of 4.14, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride is sourced from PubChem (CID 119421240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).