N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride

C17H25ClN2O — CID 119427896

IUPACN-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride
SMILESCl.O=C(CC1CCc2ccccc2C1)NC1CCCNC1
InChIInChI=1S/C17H24N2O.ClH/c20-17(19-16-6-3-9-18-12-16)11-13-7-8-14-4-1-2-5-15(14)10-13;/h1-2,4-5,13,16,18H,3,6-12H2,(H,19,20);1H
InChIKeyRYFWQHKTUGZZLB-UHFFFAOYSA-N
MW308.85 g/mol
LogP2.47
Rot. Bonds3

About N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride

N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride (PubChem CID 119427896) has the molecular formula C17H25ClN2O and a molecular weight of 308.85 g/mol. Its IUPAC name is N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride
PubChem CID119427896
Molecular FormulaC17H25ClN2O
Molecular Weight308.85 g/mol
Exact Mass308.17
IUPAC NameN-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride
SMILESCl.O=C(CC1CCc2ccccc2C1)NC1CCCNC1
InChIInChI=1S/C17H24N2O.ClH/c20-17(19-16-6-3-9-18-12-16)11-13-7-8-14-4-1-2-5-15(14)10-13;/h1-2,4-5,13,16,18H,3,6-12H2,(H,19,20);1H
InChIKeyRYFWQHKTUGZZLB-UHFFFAOYSA-N
XLogP2.47
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.85
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride?
The IUPAC name of N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride (CID 119427896) is N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride.
What is the SMILES notation for N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride?
The canonical SMILES for N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride is Cl.O=C(CC1CCc2ccccc2C1)NC1CCCNC1.
What is the InChIKey of N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride?
The InChIKey is RYFWQHKTUGZZLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O.ClH/c20-17(19-16-6-3-9-18-12-16)11-13-7-8-14-4-1-2-5-15(14)10-13;/h1-2,4-5,13,16,18H,3,6-12H2,(H,19,20);1H.
What are the key properties of N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride?
N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride has a molecular weight of 308.85 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide;hydrochloride is sourced from PubChem (CID 119427896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).