N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride

C15H27Cl2N3 — CID 119918743

IUPACN-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride
SMILESCNC1CCCN(CCN(C)c2ccccc2)C1.Cl.Cl
InChIInChI=1S/C15H25N3.2ClH/c1-16-14-7-6-10-18(13-14)12-11-17(2)15-8-4-3-5-9-15;;/h3-5,8-9,14,16H,6-7,10-13H2,1-2H3;2*1H
InChIKeyWKCKYNWJNQCHKN-UHFFFAOYSA-N
MW320.31 g/mol
LogP2.65
Rot. Bonds5

About N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride

N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride (PubChem CID 119918743) has the molecular formula C15H27Cl2N3 and a molecular weight of 320.31 g/mol. Its IUPAC name is N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride.

Molecular Properties

Compound NameN-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride
PubChem CID119918743
Molecular FormulaC15H27Cl2N3
Molecular Weight320.31 g/mol
Exact Mass319.16
IUPAC NameN-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride
SMILESCNC1CCCN(CCN(C)c2ccccc2)C1.Cl.Cl
InChIInChI=1S/C15H25N3.2ClH/c1-16-14-7-6-10-18(13-14)12-11-17(2)15-8-4-3-5-9-15;;/h3-5,8-9,14,16H,6-7,10-13H2,1-2H3;2*1H
InChIKeyWKCKYNWJNQCHKN-UHFFFAOYSA-N
XLogP2.65
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.31
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(2-pyrrolidin-1-ylethyl)aniline
CID 69244410
(3R)-1-benzyl-N-methylpiperidin-3-amine;sulfane
CID 162106706
1-(2-benzylsulfanylethyl)-N-methylpiperidin-3-amine
CID 120837970
N-methyl-1-[(E)-4-phenylbut-3-enyl]piperidin-3-amine
CID 66569635
N-methyl-1-(2-phenylpropyl)piperidin-3-amine
CID 55086340
N-methyl-N-[3-[3-(methylaminomethyl)pyrrolidin-1-yl]propyl]aniline
CID 55081287
2-(3-acetamidopiperidin-1-yl)-N-[3-(N-methylanilino)propyl]acetamide
CID 60503613
N-methyl-1-[(4-phenylphenyl)methyl]piperidin-3-amine
CID 62535196
(2R)-1-[2-(N-methylanilino)ethyl]pyrrolidine-2-carboxylic acid
CID 119913957
N-methyl-1-(naphthalen-1-ylmethyl)piperidin-3-amine
CID 62536724
N-methyl-1-[(1-phenylpyrazol-3-yl)methyl]piperidin-3-amine;hydrochloride
CID 119919223
N-[(2-bromophenyl)methyl]-N-methyl-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919983

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride?
The IUPAC name of N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride (CID 119918743) is N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride.
What is the SMILES notation for N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride?
The canonical SMILES for N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride is CNC1CCCN(CCN(C)c2ccccc2)C1.Cl.Cl.
What is the InChIKey of N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride?
The InChIKey is WKCKYNWJNQCHKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3.2ClH/c1-16-14-7-6-10-18(13-14)12-11-17(2)15-8-4-3-5-9-15;;/h3-5,8-9,14,16H,6-7,10-13H2,1-2H3;2*1H.
What are the key properties of N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride?
N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride has a molecular weight of 320.31 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(N-methylanilino)ethyl]piperidin-3-amine;dihydrochloride is sourced from PubChem (CID 119918743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).