N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine

C14H27NO2 — CID 65331868

IUPACN-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine
SMILESCCNC(CC1CCOCC1)C1CCCOC1
InChIInChI=1S/C14H27NO2/c1-2-15-14(13-4-3-7-17-11-13)10-12-5-8-16-9-6-12/h12-15H,2-11H2,1H3
InChIKeyHIVCPAHVCNZOKL-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.21
Rot. Bonds5

About N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine

N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine (PubChem CID 65331868) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine
PubChem CID65331868
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine
SMILESCCNC(CC1CCOCC1)C1CCCOC1
InChIInChI=1S/C14H27NO2/c1-2-15-14(13-4-3-7-17-11-13)10-12-5-8-16-9-6-12/h12-15H,2-11H2,1H3
InChIKeyHIVCPAHVCNZOKL-UHFFFAOYSA-N
XLogP2.21
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-ethyl-2-(oxan-4-yl)ethanamine
CID 62600215
N-ethyl-1-(oxolan-3-yl)-2-(thian-4-yl)ethanamine
CID 105147710
N-ethyl-1-(oxan-3-yl)pentan-1-amine
CID 65331760
3-(ethylamino)-3-(oxan-3-yl)propan-1-ol
CID 65239845
3-ethoxy-N-ethyl-1-(oxan-3-yl)propan-1-amine
CID 107137018
1-(3,5-dimethylcyclohexyl)-N-ethyl-2-(oxolan-3-yl)ethanamine
CID 113362179
N-ethyl-3-methoxy-3-methyl-1-(oxan-3-yl)butan-1-amine
CID 107138800
N-ethyl-2-(oxan-4-yl)-1-(thiolan-2-yl)ethanamine
CID 80622502
1,2-di(cyclobutyl)-N-ethylethanamine
CID 65456991
2-(1-adamantyl)-N-ethyl-1-(oxan-3-yl)ethanamine
CID 107139110
2-(cyclopentylmethylsulfanyl)-N-ethyl-1-(oxolan-3-yl)ethanamine
CID 113449540
N-ethyl-1-(oxan-3-yl)-3-propoxypropan-1-amine
CID 107138944

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine?
The IUPAC name of N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine (CID 65331868) is N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine is CCNC(CC1CCOCC1)C1CCCOC1.
What is the InChIKey of N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine?
The InChIKey is HIVCPAHVCNZOKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-2-15-14(13-4-3-7-17-11-13)10-12-5-8-16-9-6-12/h12-15H,2-11H2,1H3.
What are the key properties of N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine?
N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine has a molecular weight of 241.37 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine is sourced from PubChem (CID 65331868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).