N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride

C15H25ClN2 — CID 119914413

IUPACN-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride
SMILESCNCC1CCCN(C(C)c2ccccc2)C1.Cl
InChIInChI=1S/C15H24N2.ClH/c1-13(15-8-4-3-5-9-15)17-10-6-7-14(12-17)11-16-2;/h3-5,8-9,13-14,16H,6-7,10-12H2,1-2H3;1H
InChIKeyBIDZXAYETHDIIV-UHFFFAOYSA-N
MW268.83 g/mol
LogP3.10
Rot. Bonds4

About N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride

N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride (PubChem CID 119914413) has the molecular formula C15H25ClN2 and a molecular weight of 268.83 g/mol. Its IUPAC name is N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride
PubChem CID119914413
Molecular FormulaC15H25ClN2
Molecular Weight268.83 g/mol
Exact Mass268.17
IUPAC NameN-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride
SMILESCNCC1CCCN(C(C)c2ccccc2)C1.Cl
InChIInChI=1S/C15H24N2.ClH/c1-13(15-8-4-3-5-9-15)17-10-6-7-14(12-17)11-16-2;/h3-5,8-9,13-14,16H,6-7,10-12H2,1-2H3;1H
InChIKeyBIDZXAYETHDIIV-UHFFFAOYSA-N
XLogP3.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.83
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[1-[1-(4-propan-2-ylphenyl)ethyl]piperidin-3-yl]methanamine
CID 61204878
N-methyl-1-[1-(1-phenylbutyl)piperidin-3-yl]methanamine
CID 61206343
N-methyl-1-[1-[1-(2-methylphenyl)ethyl]piperidin-3-yl]methanamine
CID 61206350
1-[1-[1-(2,6-difluorophenyl)ethyl]piperidin-3-yl]-N-methylmethanamine;hydrochloride
CID 119914638
N-methyl-1-[1-[1-[3-(trifluoromethyl)phenyl]ethyl]piperidin-3-yl]methanamine
CID 61204886
N-methyl-1-[1-[1-(4-nitrophenyl)ethyl]piperidin-3-yl]methanamine
CID 61205255
N-methyl-1-[1-[1-(3-methylphenyl)ethyl]pyrrolidin-3-yl]methanamine;hydrochloride
CID 119922236
1-(1-benzhydrylpyrrolidin-3-yl)-N-methylmethanamine;ethane
CID 91616896
(3R)-3-methyl-1-[(1S)-1-phenylethyl]piperidine
CID 145119255
N-[[1-[1-(4-chlorophenyl)ethyl]piperidin-3-yl]methyl]propan-2-amine
CID 63240956
1-[3-(methylaminomethyl)piperidin-1-yl]-2,2-diphenylethanone;hydrochloride
CID 119397483
1-(1-phenylethyl)-3-propan-2-ylpiperidine
CID 134236210

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride?
The IUPAC name of N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride (CID 119914413) is N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride.
What is the SMILES notation for N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride?
The canonical SMILES for N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride is CNCC1CCCN(C(C)c2ccccc2)C1.Cl.
What is the InChIKey of N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride?
The InChIKey is BIDZXAYETHDIIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2.ClH/c1-13(15-8-4-3-5-9-15)17-10-6-7-14(12-17)11-16-2;/h3-5,8-9,13-14,16H,6-7,10-12H2,1-2H3;1H.
What are the key properties of N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride?
N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride has a molecular weight of 268.83 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride is sourced from PubChem (CID 119914413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).