N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride

C10H13Cl3N2O2 — CID 119384245

IUPACN-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride
SMILESCOc1cc(Cl)c(Cl)cc1C(=O)NCCN.Cl
InChIInChI=1S/C10H12Cl2N2O2.ClH/c1-16-9-5-8(12)7(11)4-6(9)10(15)14-3-2-13;/h4-5H,2-3,13H2,1H3,(H,14,15);1H
InChIKeyKDHMMZRMTRJHSG-UHFFFAOYSA-N
MW299.59 g/mol
LogP2.11
Rot. Bonds4

About N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride

N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride (PubChem CID 119384245) has the molecular formula C10H13Cl3N2O2 and a molecular weight of 299.59 g/mol. Its IUPAC name is N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride
PubChem CID119384245
Molecular FormulaC10H13Cl3N2O2
Molecular Weight299.59 g/mol
Exact Mass298.00
IUPAC NameN-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride
SMILESCOc1cc(Cl)c(Cl)cc1C(=O)NCCN.Cl
InChIInChI=1S/C10H12Cl2N2O2.ClH/c1-16-9-5-8(12)7(11)4-6(9)10(15)14-3-2-13;/h4-5H,2-3,13H2,1H3,(H,14,15);1H
InChIKeyKDHMMZRMTRJHSG-UHFFFAOYSA-N
XLogP2.11
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.59
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-aminoethyl)-4,5-dichloro-2-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-aminoethyl)-2-fluoro-4,5-dimethoxybenzamide
CID 119382400
N-(2-aminoethyl)-5-fluoro-2-methoxybenzamide
CID 119385341
5-chloro-N-(2-hydroxyethyl)-4-iodo-2-methoxybenzamide
CID 43419592
4-amino-5-chloro-2-methoxy-N-[3-(methylamino)propyl]benzamide
CID 122080226
5-chloro-N-(3-hydroxypropyl)-2-methoxy-4-methylbenzamide
CID 96665044
2-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-N,N-diethylethanamine oxide;hydrochloride
CID 175674084
4-acetamido-5-chloro-N-(2-hydroxyethyl)-2-methoxybenzamide
CID 154085397
4-amino-5-chloro-N-[3-(ethylsulfonylamino)propyl]-2-methoxybenzamide;hydrochloride
CID 119763146
4-amino-5-chloro-2-methoxy-N-[2-[3-methoxypropyl(methyl)amino]ethyl]benzamide
CID 119892903
5-chloro-4-iodo-2-methoxy-N-[3-(methylamino)propyl]benzamide
CID 119432128
5-chloro-N-[2-(ethylamino)ethyl]-4-iodo-2-methoxybenzamide
CID 119507340
2-chloro-4-N-[2-(diethylamino)ethyl]-5-methoxy-1-N-oxidobenzene-1,4-dicarboxamide
CID 12883877

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride (CID 119384245) is N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride is COc1cc(Cl)c(Cl)cc1C(=O)NCCN.Cl.
What is the InChIKey of N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride?
The InChIKey is KDHMMZRMTRJHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2O2.ClH/c1-16-9-5-8(12)7(11)4-6(9)10(15)14-3-2-13;/h4-5H,2-3,13H2,1H3,(H,14,15);1H.
What are the key properties of N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride?
N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride has a molecular weight of 299.59 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-4,5-dichloro-2-methoxybenzamide;hydrochloride is sourced from PubChem (CID 119384245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).