3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride

C11H23ClN2O2 — CID 119555798

IUPAC3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
SMILESCOCCC(=O)NCCC1CCCNC1.Cl
InChIInChI=1S/C11H22N2O2.ClH/c1-15-8-5-11(14)13-7-4-10-3-2-6-12-9-10;/h10,12H,2-9H2,1H3,(H,13,14);1H
InChIKeyMISCXNLEXTXCFY-UHFFFAOYSA-N
MW250.77 g/mol
LogP0.95
Rot. Bonds6

About 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride

3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride (PubChem CID 119555798) has the molecular formula C11H23ClN2O2 and a molecular weight of 250.77 g/mol. Its IUPAC name is 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
PubChem CID119555798
Molecular FormulaC11H23ClN2O2
Molecular Weight250.77 g/mol
Exact Mass250.14
IUPAC Name3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
SMILESCOCCC(=O)NCCC1CCCNC1.Cl
InChIInChI=1S/C11H22N2O2.ClH/c1-15-8-5-11(14)13-7-4-10-3-2-6-12-9-10;/h10,12H,2-9H2,1H3,(H,13,14);1H
InChIKeyMISCXNLEXTXCFY-UHFFFAOYSA-N
XLogP0.95
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.77
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride?
The IUPAC name of 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride (CID 119555798) is 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride.
What is the SMILES notation for 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride?
The canonical SMILES for 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride is COCCC(=O)NCCC1CCCNC1.Cl.
What is the InChIKey of 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride?
The InChIKey is MISCXNLEXTXCFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2.ClH/c1-15-8-5-11(14)13-7-4-10-3-2-6-12-9-10;/h10,12H,2-9H2,1H3,(H,13,14);1H.
What are the key properties of 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride?
3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride has a molecular weight of 250.77 g/mol, XLogP of 0.95, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride is sourced from PubChem (CID 119555798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).