4-cyclopentyl-N,N-dimethylaniline

C13H19N — CID 54506338

IUPAC4-cyclopentyl-N,N-dimethylaniline
SMILESCN(C)c1ccc(C2CCCC2)cc1
InChIInChI=1S/C13H19N/c1-14(2)13-9-7-12(8-10-13)11-5-3-4-6-11/h7-11H,3-6H2,1-2H3
InChIKeySXXOQLIRKNUZRJ-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.41
Rot. Bonds2

About 4-cyclopentyl-N,N-dimethylaniline

4-cyclopentyl-N,N-dimethylaniline (PubChem CID 54506338) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 4-cyclopentyl-N,N-dimethylaniline.

Molecular Properties

Compound Name4-cyclopentyl-N,N-dimethylaniline
PubChem CID54506338
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name4-cyclopentyl-N,N-dimethylaniline
SMILESCN(C)c1ccc(C2CCCC2)cc1
InChIInChI=1S/C13H19N/c1-14(2)13-9-7-12(8-10-13)11-5-3-4-6-11/h7-11H,3-6H2,1-2H3
InChIKeySXXOQLIRKNUZRJ-UHFFFAOYSA-N
XLogP3.41
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

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CID 170179749
N,N-dimethyl-4-piperidin-4-ylaniline;dihydrochloride
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cis-(1R,2R)-2-[4-(dimethylamino)phenyl]cyclohexan-1-ol
CID 26595121
N-[1-(4-cyclohexylphenyl)ethylideneamino]-4-(dimethylamino)benzamide
CID 4298976
1-(4-cyclohexyl-N-methylanilino)propan-2-one
CID 115234545
N'-(4-cyclohexylphenyl)-N'-methylpropane-1,3-diamine
CID 96675502
N-(3-chloropropyl)-4-cyclohexyl-N-methylaniline
CID 115215489
3-[4-(dimethylamino)phenyl]cyclopentane-1-carbaldehyde
CID 123170690
2-(cyclopentanecarbonyl)-5-[4-(dimethylamino)phenyl]cyclohexane-1,3-dione
CID 52950677
4-[(E)-2-(4-cyclohexylphenyl)ethenyl]-N,N-bis[4-[(E)-2-(4-cyclohexylphenyl)ethenyl]phenyl]aniline
CID 59838926
2-(4-cyclohexylphenyl)-6-(dimethylamino)-3H-isoindol-1-one
CID 67045248

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N,N-dimethylaniline?
The IUPAC name of 4-cyclopentyl-N,N-dimethylaniline (CID 54506338) is 4-cyclopentyl-N,N-dimethylaniline.
What is the SMILES notation for 4-cyclopentyl-N,N-dimethylaniline?
The canonical SMILES for 4-cyclopentyl-N,N-dimethylaniline is CN(C)c1ccc(C2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyl-N,N-dimethylaniline?
The InChIKey is SXXOQLIRKNUZRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-14(2)13-9-7-12(8-10-13)11-5-3-4-6-11/h7-11H,3-6H2,1-2H3.
What are the key properties of 4-cyclopentyl-N,N-dimethylaniline?
4-cyclopentyl-N,N-dimethylaniline has a molecular weight of 189.30 g/mol, XLogP of 3.41, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N,N-dimethylaniline is sourced from PubChem (CID 54506338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).