N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine

C15H24N2O — CID 82740072

IUPACN,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine
SMILESCNC(C)c1ccccc1N(C)C1CCOC1C
InChIInChI=1S/C15H24N2O/c1-11(16-3)13-7-5-6-8-15(13)17(4)14-9-10-18-12(14)2/h5-8,11-12,14,16H,9-10H2,1-4H3
InChIKeyOVIWCWDHGQMLEI-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.58
Rot. Bonds4

About N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine

N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine (PubChem CID 82740072) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine
PubChem CID82740072
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine
SMILESCNC(C)c1ccccc1N(C)C1CCOC1C
InChIInChI=1S/C15H24N2O/c1-11(16-3)13-7-5-6-8-15(13)17(4)14-9-10-18-12(14)2/h5-8,11-12,14,16H,9-10H2,1-4H3
InChIKeyOVIWCWDHGQMLEI-UHFFFAOYSA-N
XLogP2.58
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine?
The IUPAC name of N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine (CID 82740072) is N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine.
What is the SMILES notation for N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine?
The canonical SMILES for N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine is CNC(C)c1ccccc1N(C)C1CCOC1C.
What is the InChIKey of N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine?
The InChIKey is OVIWCWDHGQMLEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(16-3)13-7-5-6-8-15(13)17(4)14-9-10-18-12(14)2/h5-8,11-12,14,16H,9-10H2,1-4H3.
What are the key properties of N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine?
N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine has a molecular weight of 248.37 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[2-[1-(methylamino)ethyl]phenyl]oxolan-3-amine is sourced from PubChem (CID 82740072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).