N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride

C18H25ClN2 — CID 119929695

IUPACN-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride
SMILESCN(Cc1ccc2ccccc2c1)CC1CCNCC1.Cl
InChIInChI=1S/C18H24N2.ClH/c1-20(13-15-8-10-19-11-9-15)14-16-6-7-17-4-2-3-5-18(17)12-16;/h2-7,12,15,19H,8-11,13-14H2,1H3;1H
InChIKeyBSGKBIZVLGPUBD-UHFFFAOYSA-N
MW304.86 g/mol
LogP3.69
Rot. Bonds4

About N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride

N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride (PubChem CID 119929695) has the molecular formula C18H25ClN2 and a molecular weight of 304.86 g/mol. Its IUPAC name is N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride
PubChem CID119929695
Molecular FormulaC18H25ClN2
Molecular Weight304.86 g/mol
Exact Mass304.17
IUPAC NameN-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride
SMILESCN(Cc1ccc2ccccc2c1)CC1CCNCC1.Cl
InChIInChI=1S/C18H24N2.ClH/c1-20(13-15-8-10-19-11-9-15)14-16-6-7-17-4-2-3-5-18(17)12-16;/h2-7,12,15,19H,8-11,13-14H2,1H3;1H
InChIKeyBSGKBIZVLGPUBD-UHFFFAOYSA-N
XLogP3.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.86
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride?
The IUPAC name of N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride (CID 119929695) is N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride.
What is the SMILES notation for N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride?
The canonical SMILES for N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride is CN(Cc1ccc2ccccc2c1)CC1CCNCC1.Cl.
What is the InChIKey of N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride?
The InChIKey is BSGKBIZVLGPUBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2.ClH/c1-20(13-15-8-10-19-11-9-15)14-16-6-7-17-4-2-3-5-18(17)12-16;/h2-7,12,15,19H,8-11,13-14H2,1H3;1H.
What are the key properties of N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride?
N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride has a molecular weight of 304.86 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(naphthalen-2-ylmethyl)-1-piperidin-4-ylmethanamine;hydrochloride is sourced from PubChem (CID 119929695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).