N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride

C17H25Cl2N — CID 23292613

IUPACN-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride
SMILESCN(CC1(c2ccc(Cl)cc2)CCC1)C1CCCC1.Cl
InChIInChI=1S/C17H24ClN.ClH/c1-19(16-5-2-3-6-16)13-17(11-4-12-17)14-7-9-15(18)10-8-14;/h7-10,16H,2-6,11-13H2,1H3;1H
InChIKeyIADQRMHJLUKPCP-UHFFFAOYSA-N
MW314.30 g/mol
LogP5.06
Rot. Bonds4

About N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride

N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride (PubChem CID 23292613) has the molecular formula C17H25Cl2N and a molecular weight of 314.30 g/mol. Its IUPAC name is N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride.

Molecular Properties

Compound NameN-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride
PubChem CID23292613
Molecular FormulaC17H25Cl2N
Molecular Weight314.30 g/mol
Exact Mass313.14
IUPAC NameN-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride
SMILESCN(CC1(c2ccc(Cl)cc2)CCC1)C1CCCC1.Cl
InChIInChI=1S/C17H24ClN.ClH/c1-19(16-5-2-3-6-16)13-17(11-4-12-17)14-7-9-15(18)10-8-14;/h7-10,16H,2-6,11-13H2,1H3;1H
InChIKeyIADQRMHJLUKPCP-UHFFFAOYSA-N
XLogP5.06
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.30
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;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-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine
CID 23292614
N-[[1-(3,4-dichlorophenyl)cyclobutyl]methyl]-N-methylcyclohexanamine
CID 23292612
1-[1-(4-chlorophenyl)cyclobutyl]-N,N-dimethylmethanamine
CID 169436266
1-[1-(4-chlorophenyl)cyclopropyl]-N,N-dimethylmethanamine
CID 21365272
3-[1-(4-chlorophenyl)cyclobutyl]-N,N-dimethylpropan-1-amine
CID 57115633
1-(4-chlorophenyl)-N-(cyclohexylmethyl)-N-methylcyclobutan-1-amine;hydrochloride
CID 21270221
1-(4-chlorophenyl)-N-cyclopropyl-N-methylcyclobutan-1-amine
CID 23292607
1-(4-chlorophenyl)-N-cycloheptyl-N-methylcyclopropane-1-carboxamide
CID 55468765
N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N,2-dimethyltetrazol-5-amine
CID 54145288
4-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine;hydrate;hydrochloride
CID 69304082
2-[[1-(4-chlorophenyl)cyclopentyl]methyl]-1-cyclopropyl-1-methylguanidine;hydroiodide
CID 110030573
N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine
CID 59020082

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride?
The IUPAC name of N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride (CID 23292613) is N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride.
What is the SMILES notation for N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride?
The canonical SMILES for N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride is CN(CC1(c2ccc(Cl)cc2)CCC1)C1CCCC1.Cl.
What is the InChIKey of N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride?
The InChIKey is IADQRMHJLUKPCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClN.ClH/c1-19(16-5-2-3-6-16)13-17(11-4-12-17)14-7-9-15(18)10-8-14;/h7-10,16H,2-6,11-13H2,1H3;1H.
What are the key properties of N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride?
N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride has a molecular weight of 314.30 g/mol, XLogP of 5.06, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride is sourced from PubChem (CID 23292613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).