N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine

C9H20N2S — CID 63966753

IUPACN-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine
SMILESCNC1CCN(CCSC)CC1
InChIInChI=1S/C9H20N2S/c1-10-9-3-5-11(6-4-9)7-8-12-2/h9-10H,3-8H2,1-2H3
InChIKeyHQQJLJJQOAHLKQ-UHFFFAOYSA-N
MW188.34 g/mol
LogP1.03
Rot. Bonds4

About N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine

N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine (PubChem CID 63966753) has the molecular formula C9H20N2S and a molecular weight of 188.34 g/mol. Its IUPAC name is N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine
PubChem CID63966753
Molecular FormulaC9H20N2S
Molecular Weight188.34 g/mol
Exact Mass188.13
IUPAC NameN-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine
SMILESCNC1CCN(CCSC)CC1
InChIInChI=1S/C9H20N2S/c1-10-9-3-5-11(6-4-9)7-8-12-2/h9-10H,3-8H2,1-2H3
InChIKeyHQQJLJJQOAHLKQ-UHFFFAOYSA-N
XLogP1.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(3-methylsulfanylpropyl)piperidin-4-amine
CID 63965650
1-(2-methylsulfanylethyl)-4-propan-2-ylpiperidine
CID 59762113
N-methyl-1-(2-morpholin-4-ylethyl)piperidin-4-amine
CID 60819990
2-(azepan-1-yl)-N-[1-(2-methylsulfanylethyl)piperidin-4-yl]acetamide
CID 131905976
N-methyl-1-propylazepan-4-amine
CID 65072873
1-dodecyl-N-methylpiperidin-4-amine
CID 63400682
1-(2-benzylsulfanylethyl)-N-methylpiperidin-4-amine;hydrochloride
CID 120839732
1-(2-cyclopentylethyl)-N-methylpiperidin-4-amine;hydrochloride
CID 119923610
1-(3-ethoxypropyl)-N-methylpiperidin-4-amine
CID 43315421
N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride
CID 119923511
1-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidin-4-amine
CID 103815473
1-(2,2-dimethylpropyl)-N-methylpiperidin-4-amine
CID 59679434

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine?
The IUPAC name of N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine (CID 63966753) is N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine.
What is the SMILES notation for N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine?
The canonical SMILES for N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine is CNC1CCN(CCSC)CC1.
What is the InChIKey of N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine?
The InChIKey is HQQJLJJQOAHLKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2S/c1-10-9-3-5-11(6-4-9)7-8-12-2/h9-10H,3-8H2,1-2H3.
What are the key properties of N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine?
N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine has a molecular weight of 188.34 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylsulfanylethyl)piperidin-4-amine is sourced from PubChem (CID 63966753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).