N-ethyl-N-propylaniline

C11H17N — CID 13203875

IUPACN-ethyl-N-propylaniline
SMILESCCCN(CC)c1ccccc1
InChIInChI=1S/C11H17N/c1-3-10-12(4-2)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeyPAZVJIOFFOOQLQ-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.92
Rot. Bonds4

About N-ethyl-N-propylaniline

N-ethyl-N-propylaniline (PubChem CID 13203875) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is N-ethyl-N-propylaniline.

Molecular Properties

Compound NameN-ethyl-N-propylaniline
PubChem CID13203875
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC NameN-ethyl-N-propylaniline
SMILESCCCN(CC)c1ccccc1
InChIInChI=1S/C11H17N/c1-3-10-12(4-2)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeyPAZVJIOFFOOQLQ-UHFFFAOYSA-N
XLogP2.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propylaniline?
The IUPAC name of N-ethyl-N-propylaniline (CID 13203875) is N-ethyl-N-propylaniline.
What is the SMILES notation for N-ethyl-N-propylaniline?
The canonical SMILES for N-ethyl-N-propylaniline is CCCN(CC)c1ccccc1.
What is the InChIKey of N-ethyl-N-propylaniline?
The InChIKey is PAZVJIOFFOOQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-3-10-12(4-2)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3.
What are the key properties of N-ethyl-N-propylaniline?
N-ethyl-N-propylaniline has a molecular weight of 163.26 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propylaniline is sourced from PubChem (CID 13203875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).