2-[2-(dipropylamino)ethyl]phenol

C14H23NO — CID 10130700

IUPAC2-[2-(dipropylamino)ethyl]phenol
SMILESCCCN(CCC)CCc1ccccc1O
InChIInChI=1S/C14H23NO/c1-3-10-15(11-4-2)12-9-13-7-5-6-8-14(13)16/h5-8,16H,3-4,9-12H2,1-2H3
InChIKeySPVQYHCKYXBTNQ-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.06
Rot. Bonds7

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

2-[2-(dipropylamino)ethyl]phenol (PubChem CID 10130700) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-[2-(dipropylamino)ethyl]phenol.

Molecular Properties

Compound Name2-[2-(dipropylamino)ethyl]phenol
PubChem CID10130700
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-[2-(dipropylamino)ethyl]phenol
SMILESCCCN(CCC)CCc1ccccc1O
InChIInChI=1S/C14H23NO/c1-3-10-15(11-4-2)12-9-13-7-5-6-8-14(13)16/h5-8,16H,3-4,9-12H2,1-2H3
InChIKeySPVQYHCKYXBTNQ-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 2-[2-(dipropylamino)ethyl]phenol?
The IUPAC name of 2-[2-(dipropylamino)ethyl]phenol (CID 10130700) is 2-[2-(dipropylamino)ethyl]phenol.
What is the SMILES notation for 2-[2-(dipropylamino)ethyl]phenol?
The canonical SMILES for 2-[2-(dipropylamino)ethyl]phenol is CCCN(CCC)CCc1ccccc1O.
What is the InChIKey of 2-[2-(dipropylamino)ethyl]phenol?
The InChIKey is SPVQYHCKYXBTNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-3-10-15(11-4-2)12-9-13-7-5-6-8-14(13)16/h5-8,16H,3-4,9-12H2,1-2H3.
What are the key properties of 2-[2-(dipropylamino)ethyl]phenol?
2-[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 2-[2-(dipropylamino)ethyl]phenol is sourced from PubChem (CID 10130700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).