3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol

C15H24N2O — CID 43308530

IUPAC3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol
SMILESCCN1CCC(C(C)Nc2cccc(O)c2)CC1
InChIInChI=1S/C15H24N2O/c1-3-17-9-7-13(8-10-17)12(2)16-14-5-4-6-15(18)11-14/h4-6,11-13,16,18H,3,7-10H2,1-2H3
InChIKeyBLEMITWRZJQTJM-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.92
Rot. Bonds4

About 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol

3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol (PubChem CID 43308530) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol.

Molecular Properties

Compound Name3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol
PubChem CID43308530
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol
SMILESCCN1CCC(C(C)Nc2cccc(O)c2)CC1
InChIInChI=1S/C15H24N2O/c1-3-17-9-7-13(8-10-17)12(2)16-14-5-4-6-15(18)11-14/h4-6,11-13,16,18H,3,7-10H2,1-2H3
InChIKeyBLEMITWRZJQTJM-UHFFFAOYSA-N
XLogP2.92
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methylsulfanylaniline
CID 43307452
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-(trifluoromethyl)aniline
CID 43307549
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3,5-difluoroaniline
CID 43308012
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,6-difluoroaniline
CID 43308670
2,6-dichloro-N-[1-(1-ethylpiperidin-4-yl)ethyl]aniline
CID 65469902
2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline
CID 60924899
4-bromo-N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methoxyaniline
CID 82857817
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-fluoro-4-methoxyaniline
CID 43380417
4-chloro-N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methoxyaniline
CID 107620997
N-[3-[1-(1-ethylpiperidin-3-yl)ethylamino]phenyl]acetamide
CID 43307791
5-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-fluorobenzonitrile
CID 62316616
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine
CID 174414194

Frequently Asked Questions

What is the IUPAC name of 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol?
The IUPAC name of 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol (CID 43308530) is 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol.
What is the SMILES notation for 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol?
The canonical SMILES for 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol is CCN1CCC(C(C)Nc2cccc(O)c2)CC1.
What is the InChIKey of 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol?
The InChIKey is BLEMITWRZJQTJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-17-9-7-13(8-10-17)12(2)16-14-5-4-6-15(18)11-14/h4-6,11-13,16,18H,3,7-10H2,1-2H3.
What are the key properties of 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol?
3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol has a molecular weight of 248.37 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol is sourced from PubChem (CID 43308530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).