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

C17H24ClN — CID 23292614

IUPACN-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine
SMILESCN(CC1(c2ccc(Cl)cc2)CCC1)C1CCCC1
InChIInChI=1S/C17H24ClN/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
InChIKeyHELFHGRZAFIXJG-UHFFFAOYSA-N
MW277.84 g/mol
LogP4.64
Rot. Bonds4

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

N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine (PubChem CID 23292614) has the molecular formula C17H24ClN and a molecular weight of 277.84 g/mol. Its IUPAC name is N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine.

Molecular Properties

Compound NameN-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine
PubChem CID23292614
Molecular FormulaC17H24ClN
Molecular Weight277.84 g/mol
Exact Mass277.16
IUPAC NameN-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine
SMILESCN(CC1(c2ccc(Cl)cc2)CCC1)C1CCCC1
InChIInChI=1S/C17H24ClN/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
InChIKeyHELFHGRZAFIXJG-UHFFFAOYSA-N
XLogP4.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.84
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine;hydrochloride
CID 23292613
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-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
1-(4-chlorophenyl)-N-(cyclohexylmethyl)-N-methylcyclobutan-1-amine;hydrochloride
CID 21270221
2-[[1-(4-chlorophenyl)cyclopentyl]methyl]-1-cyclopropyl-1-methylguanidine;hydroiodide
CID 110030573
N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine
CID 59020082
1-[1-(4-chlorophenyl)cyclobutyl]propan-2-amine
CID 13083334

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine?
The IUPAC name of N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine (CID 23292614) is N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine.
What is the SMILES notation for N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine?
The canonical SMILES for N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine is CN(CC1(c2ccc(Cl)cc2)CCC1)C1CCCC1.
What is the InChIKey of N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine?
The InChIKey is HELFHGRZAFIXJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClN/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.
What are the key properties of N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine?
N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-N-methylcyclopentanamine has a molecular weight of 277.84 g/mol, XLogP of 4.64, 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 is sourced from PubChem (CID 23292614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).