3-[2-(dipropylamino)ethyl]phenol

C14H23NO — CID 3049326

IUPAC3-[2-(dipropylamino)ethyl]phenol
SMILESCCCN(CCC)CCc1cccc(O)c1
InChIInChI=1S/C14H23NO/c1-3-9-15(10-4-2)11-8-13-6-5-7-14(16)12-13/h5-7,12,16H,3-4,8-11H2,1-2H3
InChIKeyZNNWOWADALHHDU-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.06
Rot. Bonds7

About 3-[2-(dipropylamino)ethyl]phenol

3-[2-(dipropylamino)ethyl]phenol (PubChem CID 3049326) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 3-[2-(dipropylamino)ethyl]phenol.

Molecular Properties

Compound Name3-[2-(dipropylamino)ethyl]phenol
PubChem CID3049326
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name3-[2-(dipropylamino)ethyl]phenol
SMILESCCCN(CCC)CCc1cccc(O)c1
InChIInChI=1S/C14H23NO/c1-3-9-15(10-4-2)11-8-13-6-5-7-14(16)12-13/h5-7,12,16H,3-4,8-11H2,1-2H3
InChIKeyZNNWOWADALHHDU-UHFFFAOYSA-N
XLogP3.06
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(dipropylamino)ethyl]phenol?
The IUPAC name of 3-[2-(dipropylamino)ethyl]phenol (CID 3049326) is 3-[2-(dipropylamino)ethyl]phenol.
What is the SMILES notation for 3-[2-(dipropylamino)ethyl]phenol?
The canonical SMILES for 3-[2-(dipropylamino)ethyl]phenol is CCCN(CCC)CCc1cccc(O)c1.
What is the InChIKey of 3-[2-(dipropylamino)ethyl]phenol?
The InChIKey is ZNNWOWADALHHDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-3-9-15(10-4-2)11-8-13-6-5-7-14(16)12-13/h5-7,12,16H,3-4,8-11H2,1-2H3.
What are the key properties of 3-[2-(dipropylamino)ethyl]phenol?
3-[2-(dipropylamino)ethyl]phenol has a molecular weight of 221.34 g/mol, XLogP of 3.06, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dipropylamino)ethyl]phenol is sourced from PubChem (CID 3049326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).