3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine

C18H26ClN — CID 63448300

IUPAC3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine
SMILESClc1ccc(C2CC(NCCC3CCCCC3)C2)cc1
InChIInChI=1S/C18H26ClN/c19-17-8-6-15(7-9-17)16-12-18(13-16)20-11-10-14-4-2-1-3-5-14/h6-9,14,16,18,20H,1-5,10-13H2
InChIKeyPFCZKGAXCAUSTG-UHFFFAOYSA-N
MW291.87 g/mol
LogP5.15
Rot. Bonds5

About 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine

3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine (PubChem CID 63448300) has the molecular formula C18H26ClN and a molecular weight of 291.87 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine
PubChem CID63448300
Molecular FormulaC18H26ClN
Molecular Weight291.87 g/mol
Exact Mass291.18
IUPAC Name3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine
SMILESClc1ccc(C2CC(NCCC3CCCCC3)C2)cc1
InChIInChI=1S/C18H26ClN/c19-17-8-6-15(7-9-17)16-12-18(13-16)20-11-10-14-4-2-1-3-5-14/h6-9,14,16,18,20H,1-5,10-13H2
InChIKeyPFCZKGAXCAUSTG-UHFFFAOYSA-N
XLogP5.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500291.87
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cyclopentylethyl)-3-(4-methoxyphenyl)cyclobutan-1-amine
CID 60920137
5-chloro-N-(2-cyclohexylethyl)-2,3-dihydro-1H-inden-2-amine
CID 115348932
N-[(4-chlorophenyl)methyl]-2-cyclohexylethanamine
CID 63448624
2-[[3-(4-chlorophenyl)cyclobutyl]amino]ethanesulfonamide
CID 43635604
3-(4-chlorophenyl)-N-(2-ethoxyethyl)cyclobutan-1-amine
CID 43635778
3-(4-chlorophenyl)-N-[(E)-pent-3-enyl]cyclobutan-1-amine
CID 104530229
N-(cyclohexylmethyl)-3-(4-methylphenyl)cyclobutan-1-amine
CID 43635351
3-(4-chlorophenyl)-N-(3-phenylpropyl)cyclobutan-1-amine
CID 43634161
3-(4-bromophenyl)-N-[2-(4-chlorophenyl)ethyl]cyclobutan-1-amine
CID 43634135
N-(2-cycloundecylethyl)cyclodecanamine
CID 155180877
N-(2-cycloheptylethyl)cyclopentanamine
CID 114457795
N-(cyclohexylmethyl)-3-phenylcyclobutan-1-amine
CID 43632316

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine?
The IUPAC name of 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine (CID 63448300) is 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine.
What is the SMILES notation for 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine?
The canonical SMILES for 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine is Clc1ccc(C2CC(NCCC3CCCCC3)C2)cc1.
What is the InChIKey of 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine?
The InChIKey is PFCZKGAXCAUSTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26ClN/c19-17-8-6-15(7-9-17)16-12-18(13-16)20-11-10-14-4-2-1-3-5-14/h6-9,14,16,18,20H,1-5,10-13H2.
What are the key properties of 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine?
3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine has a molecular weight of 291.87 g/mol, XLogP of 5.15, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine is sourced from PubChem (CID 63448300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).