N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine

C15H30N2O — CID 103058730

IUPACN-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine
SMILESCCNC1CCOCC1CN1CCCCC1CC
InChIInChI=1S/C15H30N2O/c1-3-14-7-5-6-9-17(14)11-13-12-18-10-8-15(13)16-4-2/h13-16H,3-12H2,1-2H3
InChIKeyJYDSVAVVNHQNHW-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds5

About N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine

N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine (PubChem CID 103058730) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine.

Molecular Properties

Compound NameN-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine
PubChem CID103058730
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine
SMILESCCNC1CCOCC1CN1CCCCC1CC
InChIInChI=1S/C15H30N2O/c1-3-14-7-5-6-9-17(14)11-13-12-18-10-8-15(13)16-4-2/h13-16H,3-12H2,1-2H3
InChIKeyJYDSVAVVNHQNHW-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-[(2-methylazepan-1-yl)methyl]oxan-4-amine
CID 103060277
3-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]-N-ethyloxan-4-amine
CID 103059901
N-ethyl-2-[(2-ethylazepan-1-yl)methyl]cyclohexan-1-amine
CID 104692037
N-ethyl-3-(2-ethylazepan-1-yl)oxan-4-amine
CID 113441647
3-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-ylmethyl)-N-ethyloxan-4-amine
CID 103059310
[1-[[4-(ethylamino)oxan-3-yl]methyl]-3-methylpyrrolidin-2-yl]methanol
CID 103061043
3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-ylmethyl)-N-ethyloxan-4-amine
CID 103060558
[1-[[2-(ethylamino)cyclohexyl]methyl]azepan-2-yl]methanol
CID 116638196
N-[2-(2-ethylpiperidin-1-yl)ethyl]oxolan-3-amine
CID 115689238
N-ethyl-2-[(2-ethylpyrrolidin-1-yl)methyl]-4-propylcyclohexan-1-amine
CID 63482113
4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-N-ethyloxolan-3-amine
CID 66259711
N-ethyl-3-[(4-propylpiperidin-1-yl)methyl]oxan-4-amine
CID 103059033

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine?
The IUPAC name of N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine (CID 103058730) is N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine.
What is the SMILES notation for N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine?
The canonical SMILES for N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine is CCNC1CCOCC1CN1CCCCC1CC.
What is the InChIKey of N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine?
The InChIKey is JYDSVAVVNHQNHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-14-7-5-6-9-17(14)11-13-12-18-10-8-15(13)16-4-2/h13-16H,3-12H2,1-2H3.
What are the key properties of N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine?
N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[(2-ethylpiperidin-1-yl)methyl]oxan-4-amine is sourced from PubChem (CID 103058730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).