N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride

C19H25ClN2O — CID 120600973

IUPACN-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride
SMILESCC1CC(NC(=O)C(C)c2ccc3ccccc3c2)CCN1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-13-11-18(9-10-20-13)21-19(22)14(2)16-8-7-15-5-3-4-6-17(15)12-16;/h3-8,12-14,18,20H,9-11H2,1-2H3,(H,21,22);1H
InChIKeyJMALMHXYGGLUAW-UHFFFAOYSA-N
MW332.88 g/mol
LogP3.62
Rot. Bonds3

About N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride

N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride (PubChem CID 120600973) has the molecular formula C19H25ClN2O and a molecular weight of 332.88 g/mol. Its IUPAC name is N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride
PubChem CID120600973
Molecular FormulaC19H25ClN2O
Molecular Weight332.88 g/mol
Exact Mass332.17
IUPAC NameN-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride
SMILESCC1CC(NC(=O)C(C)c2ccc3ccccc3c2)CCN1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-13-11-18(9-10-20-13)21-19(22)14(2)16-8-7-15-5-3-4-6-17(15)12-16;/h3-8,12-14,18,20H,9-11H2,1-2H3,(H,21,22);1H
InChIKeyJMALMHXYGGLUAW-UHFFFAOYSA-N
XLogP3.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.88
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride?
The IUPAC name of N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride (CID 120600973) is N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride.
What is the SMILES notation for N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride?
The canonical SMILES for N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride is CC1CC(NC(=O)C(C)c2ccc3ccccc3c2)CCN1.Cl.
What is the InChIKey of N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride?
The InChIKey is JMALMHXYGGLUAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O.ClH/c1-13-11-18(9-10-20-13)21-19(22)14(2)16-8-7-15-5-3-4-6-17(15)12-16;/h3-8,12-14,18,20H,9-11H2,1-2H3,(H,21,22);1H.
What are the key properties of N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride?
N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride has a molecular weight of 332.88 g/mol, XLogP of 3.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-4-yl)-2-naphthalen-2-ylpropanamide;hydrochloride is sourced from PubChem (CID 120600973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).