N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine

C14H28N2O — CID 114431402

IUPACN-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine
SMILESCCC1CCNC(CNC2(C)CCOCC2)C1
InChIInChI=1S/C14H28N2O/c1-3-12-4-7-15-13(10-12)11-16-14(2)5-8-17-9-6-14/h12-13,15-16H,3-11H2,1-2H3
InChIKeyUGDSUXVCANPODI-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.92
Rot. Bonds4

About N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine

N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine (PubChem CID 114431402) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine.

Molecular Properties

Compound NameN-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine
PubChem CID114431402
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine
SMILESCCC1CCNC(CNC2(C)CCOCC2)C1
InChIInChI=1S/C14H28N2O/c1-3-12-4-7-15-13(10-12)11-16-14(2)5-8-17-9-6-14/h12-13,15-16H,3-11H2,1-2H3
InChIKeyUGDSUXVCANPODI-UHFFFAOYSA-N
XLogP1.92
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-ethylpiperidin-2-yl)methyl]-1-methylcyclopentan-1-amine
CID 114431221
N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine
CID 114430809
N-[(4-ethylpiperidin-2-yl)methyl]-1-(oxolan-3-yl)methanamine
CID 114431077
4-methyl-N-(oxan-4-ylmethyl)oxan-4-amine
CID 115758099
N-[(4-ethylpiperidin-2-yl)methyl]-2-methylpropan-1-amine
CID 114430810
1-(4-ethylpiperidin-2-yl)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]methanamine
CID 114113000
1-(4-ethylpiperidin-2-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine
CID 114431418
4-[[(4-ethylpiperidine-2-carbonyl)amino]methyl]oxane-4-carboxylic acid
CID 114429382
methyl 3-(4-ethylpiperidin-2-yl)-2-oxopropanoate
CID 114425893
1-(4-ethylpiperidin-2-yl)-3,3-dimethylbutan-2-ol
CID 114426002
N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 114132011
1-[[(4-ethylpiperidin-2-yl)methyl-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105421244

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine?
The IUPAC name of N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine (CID 114431402) is N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine.
What is the SMILES notation for N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine?
The canonical SMILES for N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine is CCC1CCNC(CNC2(C)CCOCC2)C1.
What is the InChIKey of N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine?
The InChIKey is UGDSUXVCANPODI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-12-4-7-15-13(10-12)11-16-14(2)5-8-17-9-6-14/h12-13,15-16H,3-11H2,1-2H3.
What are the key properties of N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine?
N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine has a molecular weight of 240.39 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylpiperidin-2-yl)methyl]-4-methyloxan-4-amine is sourced from PubChem (CID 114431402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).