4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline

C15H24N2O — CID 170761212

IUPAC4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline
SMILESCN(C)CCOc1cc(C2CCCC2)ccc1N
InChIInChI=1S/C15H24N2O/c1-17(2)9-10-18-15-11-13(7-8-14(15)16)12-5-3-4-6-12/h7-8,11-12H,3-6,9-10,16H2,1-2H3
InChIKeyZQKPPUAHLJSFDD-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.87
Rot. Bonds5

About 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline

4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline (PubChem CID 170761212) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline.

Molecular Properties

Compound Name4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline
PubChem CID170761212
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline
SMILESCN(C)CCOc1cc(C2CCCC2)ccc1N
InChIInChI=1S/C15H24N2O/c1-17(2)9-10-18-15-11-13(7-8-14(15)16)12-5-3-4-6-12/h7-8,11-12H,3-6,9-10,16H2,1-2H3
InChIKeyZQKPPUAHLJSFDD-UHFFFAOYSA-N
XLogP2.87
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

cyclohexyl 4-amino-3-[2-(dimethylamino)ethoxy]benzoate
CID 93204052
cyclopentyl 4-amino-3-[3-(dimethylamino)propoxy]benzoate
CID 93204053
4-amino-N-cyclopentyl-3-[3-(dimethylamino)propoxy]benzamide
CID 82070130
4-[4-(dimethylamino)cyclohexyl]-2-methoxyaniline
CID 135211692
3-amino-N-cyclohexyl-4-[2-(dimethylamino)ethoxy]benzamide
CID 82070507
2-[2-(dimethylamino)ethoxy]-4-(1H-pyrazol-5-yl)aniline
CID 175592621
2-[2-(dimethylamino)ethoxy]-5-iodoaniline
CID 66081959
4-N-cyclopentyl-2-ethoxy-4-N-methylbenzene-1,4-diamine
CID 63669956
4-[3-(dimethylamino)propoxy]-2-propoxyaniline
CID 63678219
N,N-dimethyl-2-(4-piperidin-4-ylphenoxy)ethanamine;hydrochloride
CID 164705135
N-(2-acetamidoethyl)-4-amino-3-[2-(dimethylamino)ethoxy]benzamide
CID 93216697
2-chloro-4-cyclohexylaniline
CID 18451501

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline?
The IUPAC name of 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline (CID 170761212) is 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline.
What is the SMILES notation for 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline?
The canonical SMILES for 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline is CN(C)CCOc1cc(C2CCCC2)ccc1N.
What is the InChIKey of 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline?
The InChIKey is ZQKPPUAHLJSFDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-17(2)9-10-18-15-11-13(7-8-14(15)16)12-5-3-4-6-12/h7-8,11-12H,3-6,9-10,16H2,1-2H3.
What are the key properties of 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline?
4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline has a molecular weight of 248.37 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-2-[2-(dimethylamino)ethoxy]aniline is sourced from PubChem (CID 170761212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).