N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride

C15H24Cl2N2O3 — CID 119498520

IUPACN-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride
SMILESCCCOc1c(Cl)cc(C(=O)NCCC(C)N)cc1OC.Cl
InChIInChI=1S/C15H23ClN2O3.ClH/c1-4-7-21-14-12(16)8-11(9-13(14)20-3)15(19)18-6-5-10(2)17;/h8-10H,4-7,17H2,1-3H3,(H,18,19);1H
InChIKeyPZHNMAPJEVRAQY-UHFFFAOYSA-N
MW351.27 g/mol
LogP3.03
Rot. Bonds8

About N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride

N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride (PubChem CID 119498520) has the molecular formula C15H24Cl2N2O3 and a molecular weight of 351.27 g/mol. Its IUPAC name is N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride.

Molecular Properties

Compound NameN-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride
PubChem CID119498520
Molecular FormulaC15H24Cl2N2O3
Molecular Weight351.27 g/mol
Exact Mass350.12
IUPAC NameN-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride
SMILESCCCOc1c(Cl)cc(C(=O)NCCC(C)N)cc1OC.Cl
InChIInChI=1S/C15H23ClN2O3.ClH/c1-4-7-21-14-12(16)8-11(9-13(14)20-3)15(19)18-6-5-10(2)17;/h8-10H,4-7,17H2,1-3H3,(H,18,19);1H
InChIKeyPZHNMAPJEVRAQY-UHFFFAOYSA-N
XLogP3.03
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.27
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;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

3-chloro-5-methoxy-4-propoxy-N-propylbenzamide
CID 7333465
3-chloro-N-(2-hydroxypropyl)-5-methoxy-4-propoxybenzamide
CID 78856166
3-chloro-4,5-dimethoxy-N-(3-methylbutyl)benzamide
CID 26253252
N-(2-amino-2-ethylbutyl)-3-chloro-5-methoxy-4-propoxybenzamide
CID 119642923
3-chloro-4-ethoxy-N-(3-hydroxypentyl)-5-methoxybenzamide
CID 71848078
ethyl (2R,3R)-2-[(3-chloro-5-methoxy-4-propoxybenzoyl)amino]-3-methylpentanoate
CID 95782335
N-(3-aminobutyl)-4-bromo-3,5-dimethoxybenzamide;hydrochloride
CID 119494813
3-chloro-5-methoxy-N-[(2-methoxyphenyl)methyl]-4-propoxybenzamide
CID 26775880
3-chloro-5-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)-4-propoxybenzamide
CID 46532855
3-chloro-5-methoxy-N-[2-(3-methylphenoxy)ethyl]-4-propoxybenzamide
CID 31326626
[2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 3-chloro-5-methoxy-4-propoxybenzoate
CID 7684085
3-chloro-5-methoxy-4-propoxy-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119537034

Frequently Asked Questions

What is the IUPAC name of N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride?
The IUPAC name of N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride (CID 119498520) is N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride.
What is the SMILES notation for N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride?
The canonical SMILES for N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride is CCCOc1c(Cl)cc(C(=O)NCCC(C)N)cc1OC.Cl.
What is the InChIKey of N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride?
The InChIKey is PZHNMAPJEVRAQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2O3.ClH/c1-4-7-21-14-12(16)8-11(9-13(14)20-3)15(19)18-6-5-10(2)17;/h8-10H,4-7,17H2,1-3H3,(H,18,19);1H.
What are the key properties of N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride?
N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride has a molecular weight of 351.27 g/mol, XLogP of 3.03, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminobutyl)-3-chloro-5-methoxy-4-propoxybenzamide;hydrochloride is sourced from PubChem (CID 119498520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).