N-(1-cyclopentylpiperidin-4-yl)oxyaniline

C16H24N2O — CID 141120848

IUPACN-(1-cyclopentylpiperidin-4-yl)oxyaniline
SMILESc1ccc(NOC2CCN(C3CCCC3)CC2)cc1
InChIInChI=1S/C16H24N2O/c1-2-6-14(7-3-1)17-19-16-10-12-18(13-11-16)15-8-4-5-9-15/h1-3,6-7,15-17H,4-5,8-13H2
InChIKeyVGRHKCYIXDWQCZ-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.44
Rot. Bonds4

About N-(1-cyclopentylpiperidin-4-yl)oxyaniline

N-(1-cyclopentylpiperidin-4-yl)oxyaniline (PubChem CID 141120848) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(1-cyclopentylpiperidin-4-yl)oxyaniline.

Molecular Properties

Compound NameN-(1-cyclopentylpiperidin-4-yl)oxyaniline
PubChem CID141120848
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(1-cyclopentylpiperidin-4-yl)oxyaniline
SMILESc1ccc(NOC2CCN(C3CCCC3)CC2)cc1
InChIInChI=1S/C16H24N2O/c1-2-6-14(7-3-1)17-19-16-10-12-18(13-11-16)15-8-4-5-9-15/h1-3,6-7,15-17H,4-5,8-13H2
InChIKeyVGRHKCYIXDWQCZ-UHFFFAOYSA-N
XLogP3.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-(1-cyclobutylpiperidin-4-yl)oxy-N-phenylpyridin-3-amine
CID 66784320
1-cycloheptyl-4-phenylpiperazine
CID 2846720
1-cyclodecyl-4-phenylpiperidine;hydrochloride
CID 70215634
(1-cyclobutylpiperidin-4-yl) benzoate
CID 174573868
N-(1-cyclooctylpiperidin-4-yl)pyridin-3-amine
CID 141369101
N-phenyl-4-piperidin-1-ylpiperidin-1-amine
CID 70140619
3-anilino-1-(1-cyclopentylpiperidin-4-yl)-1-(methylamino)propan-2-one
CID 22135168
N-(2-chlorophenyl)-1-cycloheptylpiperidin-4-amine
CID 3576043
(3S)-1-cyclopentyl-3-phenylpyrrolidine
CID 97327940
2-anilinooxycycloheptan-1-one
CID 23124527
3-(4-cyclopentylpiperazin-1-yl)-N-phenylpropanamide
CID 86928095
N-[2-(4-cyclopentylpiperazin-1-yl)phenyl]hydroxylamine
CID 156796877

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylpiperidin-4-yl)oxyaniline?
The IUPAC name of N-(1-cyclopentylpiperidin-4-yl)oxyaniline (CID 141120848) is N-(1-cyclopentylpiperidin-4-yl)oxyaniline.
What is the SMILES notation for N-(1-cyclopentylpiperidin-4-yl)oxyaniline?
The canonical SMILES for N-(1-cyclopentylpiperidin-4-yl)oxyaniline is c1ccc(NOC2CCN(C3CCCC3)CC2)cc1.
What is the InChIKey of N-(1-cyclopentylpiperidin-4-yl)oxyaniline?
The InChIKey is VGRHKCYIXDWQCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-6-14(7-3-1)17-19-16-10-12-18(13-11-16)15-8-4-5-9-15/h1-3,6-7,15-17H,4-5,8-13H2.
What are the key properties of N-(1-cyclopentylpiperidin-4-yl)oxyaniline?
N-(1-cyclopentylpiperidin-4-yl)oxyaniline has a molecular weight of 260.38 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylpiperidin-4-yl)oxyaniline is sourced from PubChem (CID 141120848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).