3-morpholin-4-ylpropan-1-amine;hydrochloride

C7H17ClN2O — CID 15619129

IUPAC3-morpholin-4-ylpropan-1-amine;hydrochloride
SMILESCl.NCCCN1CCOCC1
InChIInChI=1S/C7H16N2O.ClH/c8-2-1-3-9-4-6-10-7-5-9;/h1-8H2;1H
InChIKeyHCTBOZOAFWFRDH-UHFFFAOYSA-N
MW180.68 g/mol
LogP0.09
Rot. Bonds3

About 3-morpholin-4-ylpropan-1-amine;hydrochloride

3-morpholin-4-ylpropan-1-amine;hydrochloride (PubChem CID 15619129) has the molecular formula C7H17ClN2O and a molecular weight of 180.68 g/mol. Its IUPAC name is 3-morpholin-4-ylpropan-1-amine;hydrochloride.

Molecular Properties

Compound Name3-morpholin-4-ylpropan-1-amine;hydrochloride
PubChem CID15619129
Molecular FormulaC7H17ClN2O
Molecular Weight180.68 g/mol
Exact Mass180.10
IUPAC Name3-morpholin-4-ylpropan-1-amine;hydrochloride
SMILESCl.NCCCN1CCOCC1
InChIInChI=1S/C7H16N2O.ClH/c8-2-1-3-9-4-6-10-7-5-9;/h1-8H2;1H
InChIKeyHCTBOZOAFWFRDH-UHFFFAOYSA-N
XLogP0.09
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.68
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-ylpropan-1-amine;hydrochloride?
The IUPAC name of 3-morpholin-4-ylpropan-1-amine;hydrochloride (CID 15619129) is 3-morpholin-4-ylpropan-1-amine;hydrochloride.
What is the SMILES notation for 3-morpholin-4-ylpropan-1-amine;hydrochloride?
The canonical SMILES for 3-morpholin-4-ylpropan-1-amine;hydrochloride is Cl.NCCCN1CCOCC1.
What is the InChIKey of 3-morpholin-4-ylpropan-1-amine;hydrochloride?
The InChIKey is HCTBOZOAFWFRDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O.ClH/c8-2-1-3-9-4-6-10-7-5-9;/h1-8H2;1H.
What are the key properties of 3-morpholin-4-ylpropan-1-amine;hydrochloride?
3-morpholin-4-ylpropan-1-amine;hydrochloride has a molecular weight of 180.68 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-ylpropan-1-amine;hydrochloride is sourced from PubChem (CID 15619129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).