N-(2-methoxy-1-phenylethyl)oxolan-3-amine

C13H19NO2 — CID 115889939

IUPACN-(2-methoxy-1-phenylethyl)oxolan-3-amine
SMILESCOCC(NC1CCOC1)c1ccccc1
InChIInChI=1S/C13H19NO2/c1-15-10-13(11-5-3-2-4-6-11)14-12-7-8-16-9-12/h2-6,12-14H,7-10H2,1H3
InChIKeyRJFCXRUCJGJGIP-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.75
Rot. Bonds5

About N-(2-methoxy-1-phenylethyl)oxolan-3-amine

N-(2-methoxy-1-phenylethyl)oxolan-3-amine (PubChem CID 115889939) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(2-methoxy-1-phenylethyl)oxolan-3-amine.

Molecular Properties

Compound NameN-(2-methoxy-1-phenylethyl)oxolan-3-amine
PubChem CID115889939
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-(2-methoxy-1-phenylethyl)oxolan-3-amine
SMILESCOCC(NC1CCOC1)c1ccccc1
InChIInChI=1S/C13H19NO2/c1-15-10-13(11-5-3-2-4-6-11)14-12-7-8-16-9-12/h2-6,12-14H,7-10H2,1H3
InChIKeyRJFCXRUCJGJGIP-UHFFFAOYSA-N
XLogP1.75
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxy-1-phenylethyl)cyclopentanamine
CID 84596036
N-(3,3-dimethyl-1-phenylbutyl)oxolan-3-amine
CID 63335747
4-[(2-methoxy-1-phenylethyl)amino]cyclohexane-1-carboxylic acid
CID 103466167
N-(2-methoxy-1-phenylethyl)-1-methylpyrrolidin-3-amine
CID 103902264
N-[1-(3-fluorophenyl)propyl]oxolan-3-amine
CID 114871720
N-(1-phenylpropyl)oxetan-3-amine
CID 63624948
N-(2,2-diphenylethyl)oxolan-3-amine
CID 103748167
N-(1,3-diphenylpropan-2-yl)oxolan-3-amine
CID 80719225
N-(4-phenylbutan-2-yl)oxolan-3-amine
CID 63331840
N-[1-(4-methoxyphenyl)propyl]oxan-3-amine
CID 63359865
6-[[(1R)-2-methoxy-1-phenylethyl]amino]-3-(oxan-4-yl)-1H-pyrimidine-2,4-dione
CID 178165251
tert-butyl N-[2-(oxolan-3-ylamino)-1-phenylethyl]carbamate
CID 103748482

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-1-phenylethyl)oxolan-3-amine?
The IUPAC name of N-(2-methoxy-1-phenylethyl)oxolan-3-amine (CID 115889939) is N-(2-methoxy-1-phenylethyl)oxolan-3-amine.
What is the SMILES notation for N-(2-methoxy-1-phenylethyl)oxolan-3-amine?
The canonical SMILES for N-(2-methoxy-1-phenylethyl)oxolan-3-amine is COCC(NC1CCOC1)c1ccccc1.
What is the InChIKey of N-(2-methoxy-1-phenylethyl)oxolan-3-amine?
The InChIKey is RJFCXRUCJGJGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-15-10-13(11-5-3-2-4-6-11)14-12-7-8-16-9-12/h2-6,12-14H,7-10H2,1H3.
What are the key properties of N-(2-methoxy-1-phenylethyl)oxolan-3-amine?
N-(2-methoxy-1-phenylethyl)oxolan-3-amine has a molecular weight of 221.30 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-1-phenylethyl)oxolan-3-amine is sourced from PubChem (CID 115889939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).