N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine

C13H26N2O — CID 115118538

IUPACN-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine
SMILESCN(CCC1CCOCC1)C1CCNCC1
InChIInChI=1S/C13H26N2O/c1-15(13-2-7-14-8-3-13)9-4-12-5-10-16-11-6-12/h12-14H,2-11H2,1H3
InChIKeyRTGIGVKSVXXTOI-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds4

About N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine

N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine (PubChem CID 115118538) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine
PubChem CID115118538
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine
SMILESCN(CCC1CCOCC1)C1CCNCC1
InChIInChI=1S/C13H26N2O/c1-15(13-2-7-14-8-3-13)9-4-12-5-10-16-11-6-12/h12-14H,2-11H2,1H3
InChIKeyRTGIGVKSVXXTOI-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-dimethyl-N,N'-di(piperidin-4-yl)ethane-1,2-diamine;tetrahydrochloride
CID 18770418
N,3,5-trimethyl-N-(2-piperidin-4-ylethyl)cyclohexan-1-amine
CID 66273011
N-methyl-N-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 64567145
N-methyl-2-(oxan-4-yl)-N-(piperidin-3-ylmethyl)ethanamine
CID 115209752
N-methyl-N-(2-piperidin-2-ylethyl)oxan-4-amine
CID 43611270
3-ethyl-N-methyl-N-(2-piperidin-4-ylethyl)cyclohexan-1-amine
CID 66272159
N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine
CID 115514843
N,4-dimethyl-N-(3-piperidin-4-ylpropyl)cyclohexan-1-amine
CID 62212511
N-methyl-N-(oxan-4-ylmethyl)cyclopropanamine
CID 70661195
3-[methyl(piperidin-4-yl)amino]propan-1-ol
CID 12019499
N-butyl-N-methylpiperidin-4-amine;dihydrochloride
CID 53410849
N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine
CID 43611345

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine?
The IUPAC name of N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine (CID 115118538) is N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine.
What is the SMILES notation for N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine?
The canonical SMILES for N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine is CN(CCC1CCOCC1)C1CCNCC1.
What is the InChIKey of N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine?
The InChIKey is RTGIGVKSVXXTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-15(13-2-7-14-8-3-13)9-4-12-5-10-16-11-6-12/h12-14H,2-11H2,1H3.
What are the key properties of N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine?
N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine is sourced from PubChem (CID 115118538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).