N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine

C11H21NO2 — CID 82834063

IUPACN-[(5-methyloxolan-2-yl)methyl]oxan-4-amine
SMILESCC1CCC(CNC2CCOCC2)O1
InChIInChI=1S/C11H21NO2/c1-9-2-3-11(14-9)8-12-10-4-6-13-7-5-10/h9-12H,2-8H2,1H3
InChIKeyRFGBXZUZWWHTRS-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.32
Rot. Bonds3

About N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine

N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine (PubChem CID 82834063) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine.

Molecular Properties

Compound NameN-[(5-methyloxolan-2-yl)methyl]oxan-4-amine
PubChem CID82834063
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-[(5-methyloxolan-2-yl)methyl]oxan-4-amine
SMILESCC1CCC(CNC2CCOCC2)O1
InChIInChI=1S/C11H21NO2/c1-9-2-3-11(14-9)8-12-10-4-6-13-7-5-10/h9-12H,2-8H2,1H3
InChIKeyRFGBXZUZWWHTRS-UHFFFAOYSA-N
XLogP1.32
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine?
The IUPAC name of N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine (CID 82834063) is N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine.
What is the SMILES notation for N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine?
The canonical SMILES for N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine is CC1CCC(CNC2CCOCC2)O1.
What is the InChIKey of N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine?
The InChIKey is RFGBXZUZWWHTRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9-2-3-11(14-9)8-12-10-4-6-13-7-5-10/h9-12H,2-8H2,1H3.
What are the key properties of N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine?
N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine has a molecular weight of 199.29 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine is sourced from PubChem (CID 82834063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).