2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine

C16H34N2O — CID 19822691

IUPAC2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CC(C)OCCN1CCCCC1
InChIInChI=1S/C16H34N2O/c1-4-9-18(10-5-2)15-16(3)19-14-13-17-11-7-6-8-12-17/h16H,4-15H2,1-3H3
InChIKeyHXMCLRFZPFGCJH-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.00
Rot. Bonds10

About 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine

2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine (PubChem CID 19822691) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine.

Molecular Properties

Compound Name2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine
PubChem CID19822691
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CC(C)OCCN1CCCCC1
InChIInChI=1S/C16H34N2O/c1-4-9-18(10-5-2)15-16(3)19-14-13-17-11-7-6-8-12-17/h16H,4-15H2,1-3H3
InChIKeyHXMCLRFZPFGCJH-UHFFFAOYSA-N
XLogP3.00
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine?
The IUPAC name of 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine (CID 19822691) is 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine.
What is the SMILES notation for 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine?
The canonical SMILES for 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine is CCCN(CCC)CC(C)OCCN1CCCCC1.
What is the InChIKey of 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine?
The InChIKey is HXMCLRFZPFGCJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-4-9-18(10-5-2)15-16(3)19-14-13-17-11-7-6-8-12-17/h16H,4-15H2,1-3H3.
What are the key properties of 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine?
2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine has a molecular weight of 270.46 g/mol, XLogP of 3.00, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-piperidin-1-ylethoxy)-N,N-dipropylpropan-1-amine is sourced from PubChem (CID 19822691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).