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

C17H23ClN2 — CID 119923658

IUPACN-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride
SMILESCNC1CCN(Cc2ccc3ccccc3c2)CC1.Cl
InChIInChI=1S/C17H22N2.ClH/c1-18-17-8-10-19(11-9-17)13-14-6-7-15-4-2-3-5-16(15)12-14;/h2-7,12,17-18H,8-11,13H2,1H3;1H
InChIKeyIRTXHPMXQNCREA-UHFFFAOYSA-N
MW290.84 g/mol
LogP3.45
Rot. Bonds3

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

N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride (PubChem CID 119923658) has the molecular formula C17H23ClN2 and a molecular weight of 290.84 g/mol. Its IUPAC name is N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride
PubChem CID119923658
Molecular FormulaC17H23ClN2
Molecular Weight290.84 g/mol
Exact Mass290.15
IUPAC NameN-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride
SMILESCNC1CCN(Cc2ccc3ccccc3c2)CC1.Cl
InChIInChI=1S/C17H22N2.ClH/c1-18-17-8-10-19(11-9-17)13-14-6-7-15-4-2-3-5-16(15)12-14;/h2-7,12,17-18H,8-11,13H2,1H3;1H
InChIKeyIRTXHPMXQNCREA-UHFFFAOYSA-N
XLogP3.45
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.84
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-1-(naphthalen-2-ylmethyl)piperidine
CID 15153361
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
1-[(4-bromophenyl)methyl]-N-methylpiperidin-4-amine;hydrochloride
CID 119923471
N-methyl-1-[(4-methylphenyl)methyl]piperidin-4-amine
CID 43315345
2-[methyl-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]amino]acetic acid
CID 122042974
N-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-4-amine
CID 60820296
1-[1-(naphthalen-2-ylmethyl)pyrrolidin-3-yl]ethanamine
CID 112630094
[1-(naphthalen-2-ylmethyl)piperidin-4-yl]-phenylmethanone
CID 19771944
2-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]ethylcarbamic acid
CID 68849796
N-methyl-1-[[6-(5-phenylpentoxy)naphthalen-2-yl]methyl]pyrrolidin-3-amine
CID 66689031
2-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]hexanoic acid;dihydrochloride
CID 142749256
1,6-dimethyl-4-[[1-(naphthalen-2-ylmethyl)piperidin-4-yl]amino]quinolin-2-one
CID 20817724

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride?
The IUPAC name of N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride (CID 119923658) is N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride.
What is the SMILES notation for N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride?
The canonical SMILES for N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride is CNC1CCN(Cc2ccc3ccccc3c2)CC1.Cl.
What is the InChIKey of N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride?
The InChIKey is IRTXHPMXQNCREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2.ClH/c1-18-17-8-10-19(11-9-17)13-14-6-7-15-4-2-3-5-16(15)12-14;/h2-7,12,17-18H,8-11,13H2,1H3;1H.
What are the key properties of N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride?
N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride has a molecular weight of 290.84 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(naphthalen-2-ylmethyl)piperidin-4-amine;hydrochloride is sourced from PubChem (CID 119923658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).