N-ethyl-N-(oxan-2-ylmethyl)ethanamine

C10H21NO — CID 58080190

IUPACN-ethyl-N-(oxan-2-ylmethyl)ethanamine
SMILESCCN(CC)CC1CCCCO1
InChIInChI=1S/C10H21NO/c1-3-11(4-2)9-10-7-5-6-8-12-10/h10H,3-9H2,1-2H3
InChIKeyNUTNZBFUHCLHKD-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.90
Rot. Bonds4

About N-ethyl-N-(oxan-2-ylmethyl)ethanamine

N-ethyl-N-(oxan-2-ylmethyl)ethanamine (PubChem CID 58080190) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N-ethyl-N-(oxan-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-(oxan-2-ylmethyl)ethanamine
PubChem CID58080190
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN-ethyl-N-(oxan-2-ylmethyl)ethanamine
SMILESCCN(CC)CC1CCCCO1
InChIInChI=1S/C10H21NO/c1-3-11(4-2)9-10-7-5-6-8-12-10/h10H,3-9H2,1-2H3
InChIKeyNUTNZBFUHCLHKD-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(oxan-2-ylmethyl)ethanamine?
The IUPAC name of N-ethyl-N-(oxan-2-ylmethyl)ethanamine (CID 58080190) is N-ethyl-N-(oxan-2-ylmethyl)ethanamine.
What is the SMILES notation for N-ethyl-N-(oxan-2-ylmethyl)ethanamine?
The canonical SMILES for N-ethyl-N-(oxan-2-ylmethyl)ethanamine is CCN(CC)CC1CCCCO1.
What is the InChIKey of N-ethyl-N-(oxan-2-ylmethyl)ethanamine?
The InChIKey is NUTNZBFUHCLHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-11(4-2)9-10-7-5-6-8-12-10/h10H,3-9H2,1-2H3.
What are the key properties of N-ethyl-N-(oxan-2-ylmethyl)ethanamine?
N-ethyl-N-(oxan-2-ylmethyl)ethanamine has a molecular weight of 171.28 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(oxan-2-ylmethyl)ethanamine is sourced from PubChem (CID 58080190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).