N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride

C15H22Cl3N3O3S — CID 119567663

IUPACN-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride
SMILESCl.NCC1(NC(=O)CCNS(=O)(=O)c2c(Cl)cccc2Cl)CCCC1
InChIInChI=1S/C15H21Cl2N3O3S.ClH/c16-11-4-3-5-12(17)14(11)24(22,23)19-9-6-13(21)20-15(10-18)7-1-2-8-15;/h3-5,19H,1-2,6-10,18H2,(H,20,21);1H
InChIKeySALADZLEZLHVAJ-UHFFFAOYSA-N
MW430.79 g/mol
LogP2.47
Rot. Bonds7

About N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride

N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride (PubChem CID 119567663) has the molecular formula C15H22Cl3N3O3S and a molecular weight of 430.79 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride
PubChem CID119567663
Molecular FormulaC15H22Cl3N3O3S
Molecular Weight430.79 g/mol
Exact Mass429.04
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride
SMILESCl.NCC1(NC(=O)CCNS(=O)(=O)c2c(Cl)cccc2Cl)CCCC1
InChIInChI=1S/C15H21Cl2N3O3S.ClH/c16-11-4-3-5-12(17)14(11)24(22,23)19-9-6-13(21)20-15(10-18)7-1-2-8-15;/h3-5,19H,1-2,6-10,18H2,(H,20,21);1H
InChIKeySALADZLEZLHVAJ-UHFFFAOYSA-N
XLogP2.47
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.79
LogP ≤ 52.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;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-[1-(aminomethyl)cyclopentyl]-3-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide;hydrochloride
CID 119565883
N-[1-(aminomethyl)cyclopentyl]-3-[(4-fluorophenyl)sulfonylamino]propanamide;hydrochloride
CID 119564864
N-[1-(aminomethyl)cyclopentyl]-3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanamide
CID 119567689
N-[1-(aminomethyl)cyclopentyl]-3-(2-chlorophenoxy)propanamide;hydrochloride
CID 119565936
3-[(2,6-dichlorophenyl)sulfonylamino]propanoic acid
CID 697936
N-(2-amino-1-cyclopropylethyl)-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide
CID 119616695
N-[1-(aminomethyl)cyclopentyl]-2-(2-chloro-6-fluorophenyl)acetamide
CID 63887000
N-(4-aminobutyl)-2,6-dichlorobenzenesulfonamide;hydrochloride
CID 120583800
4-[3-[(2,6-dichlorophenyl)sulfonylamino]propanoylamino]butanoic acid
CID 119352507
N-(3-aminobutyl)-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide
CID 119498614
N-[1-(aminomethyl)cyclopentyl]-4-oxo-4-phenylbutanamide;hydrochloride
CID 119568158
N-[1-(aminomethyl)cyclopentyl]-3-(2,4-dichlorophenoxy)propanamide;hydrochloride
CID 119567423

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride (CID 119567663) is N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride is Cl.NCC1(NC(=O)CCNS(=O)(=O)c2c(Cl)cccc2Cl)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride?
The InChIKey is SALADZLEZLHVAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21Cl2N3O3S.ClH/c16-11-4-3-5-12(17)14(11)24(22,23)19-9-6-13(21)20-15(10-18)7-1-2-8-15;/h3-5,19H,1-2,6-10,18H2,(H,20,21);1H.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride?
N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride has a molecular weight of 430.79 g/mol, XLogP of 2.47, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-3-[(2,6-dichlorophenyl)sulfonylamino]propanamide;hydrochloride is sourced from PubChem (CID 119567663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).