2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine

C14H28N2O — CID 106623629

IUPAC2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine
SMILESCCC1CC(N(C)CC2CCCNC2)CCO1
InChIInChI=1S/C14H28N2O/c1-3-14-9-13(6-8-17-14)16(2)11-12-5-4-7-15-10-12/h12-15H,3-11H2,1-2H3
InChIKeyBPCXYTBIBTYCPR-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds4

About 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine

2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine (PubChem CID 106623629) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine.

Molecular Properties

Compound Name2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine
PubChem CID106623629
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine
SMILESCCC1CC(N(C)CC2CCCNC2)CCO1
InChIInChI=1S/C14H28N2O/c1-3-14-9-13(6-8-17-14)16(2)11-12-5-4-7-15-10-12/h12-15H,3-11H2,1-2H3
InChIKeyBPCXYTBIBTYCPR-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine
CID 43611345
N-(piperidin-3-ylmethyl)-N,2-dipropyloxan-4-amine
CID 106625371
N,3-dimethyl-N-(piperidin-3-ylmethyl)cyclohexan-1-amine
CID 61447317
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-propyloxan-4-amine
CID 106624199
2-ethyl-N,2-dimethyl-N-(piperidin-3-ylmethyl)oxan-4-amine
CID 106623661
N-methyl-N-(piperidin-3-ylmethyl)thian-4-amine
CID 106623912
(3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine
CID 86323316
N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine
CID 106625470
3-[[(4S)-4-methyloxan-2-yl]methyl]piperidine
CID 138580415
N-(oxan-2-ylmethyl)-N-(piperidin-3-ylmethyl)propan-1-amine
CID 113267802
N-(cyclobutylmethyl)-N-methylazepan-3-amine
CID 62855304
N-[4-[methyl(piperidin-3-ylmethyl)amino]cyclohexyl]acetamide
CID 120849562

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine?
The IUPAC name of 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine (CID 106623629) is 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine.
What is the SMILES notation for 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine?
The canonical SMILES for 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine is CCC1CC(N(C)CC2CCCNC2)CCO1.
What is the InChIKey of 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine?
The InChIKey is BPCXYTBIBTYCPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-14-9-13(6-8-17-14)16(2)11-12-5-4-7-15-10-12/h12-15H,3-11H2,1-2H3.
What are the key properties of 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine?
2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine is sourced from PubChem (CID 106623629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).