N-(2-methoxycyclohexyl)oxolan-3-amine

C11H21NO2 — CID 80717087

IUPACN-(2-methoxycyclohexyl)oxolan-3-amine
SMILESCOC1CCCCC1NC1CCOC1
InChIInChI=1S/C11H21NO2/c1-13-11-5-3-2-4-10(11)12-9-6-7-14-8-9/h9-12H,2-8H2,1H3
InChIKeyURTDOHNQTVFSDG-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.32
Rot. Bonds3

About N-(2-methoxycyclohexyl)oxolan-3-amine

N-(2-methoxycyclohexyl)oxolan-3-amine (PubChem CID 80717087) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-(2-methoxycyclohexyl)oxolan-3-amine.

Molecular Properties

Compound NameN-(2-methoxycyclohexyl)oxolan-3-amine
PubChem CID80717087
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-(2-methoxycyclohexyl)oxolan-3-amine
SMILESCOC1CCCCC1NC1CCOC1
InChIInChI=1S/C11H21NO2/c1-13-11-5-3-2-4-10(11)12-9-6-7-14-8-9/h9-12H,2-8H2,1H3
InChIKeyURTDOHNQTVFSDG-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-(2-methoxycyclohexyl)oxolan-3-amine?
The IUPAC name of N-(2-methoxycyclohexyl)oxolan-3-amine (CID 80717087) is N-(2-methoxycyclohexyl)oxolan-3-amine.
What is the SMILES notation for N-(2-methoxycyclohexyl)oxolan-3-amine?
The canonical SMILES for N-(2-methoxycyclohexyl)oxolan-3-amine is COC1CCCCC1NC1CCOC1.
What is the InChIKey of N-(2-methoxycyclohexyl)oxolan-3-amine?
The InChIKey is URTDOHNQTVFSDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-13-11-5-3-2-4-10(11)12-9-6-7-14-8-9/h9-12H,2-8H2,1H3.
What are the key properties of N-(2-methoxycyclohexyl)oxolan-3-amine?
N-(2-methoxycyclohexyl)oxolan-3-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-(2-methoxycyclohexyl)oxolan-3-amine is sourced from PubChem (CID 80717087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).