N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine

C15H24N2O — CID 63335462

IUPACN-[2-(diethylaminomethyl)phenyl]oxolan-3-amine
SMILESCCN(CC)Cc1ccccc1NC1CCOC1
InChIInChI=1S/C15H24N2O/c1-3-17(4-2)11-13-7-5-6-8-15(13)16-14-9-10-18-12-14/h5-8,14,16H,3-4,9-12H2,1-2H3
InChIKeyCLZFMNNRONLNEB-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.73
Rot. Bonds6

About N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine

N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine (PubChem CID 63335462) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine.

Molecular Properties

Compound NameN-[2-(diethylaminomethyl)phenyl]oxolan-3-amine
PubChem CID63335462
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[2-(diethylaminomethyl)phenyl]oxolan-3-amine
SMILESCCN(CC)Cc1ccccc1NC1CCOC1
InChIInChI=1S/C15H24N2O/c1-3-17(4-2)11-13-7-5-6-8-15(13)16-14-9-10-18-12-14/h5-8,14,16H,3-4,9-12H2,1-2H3
InChIKeyCLZFMNNRONLNEB-UHFFFAOYSA-N
XLogP2.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-(diethylaminomethyl)aniline
CID 43729330
2-(diethylaminomethyl)-N-(3,5-dimethylcyclohexyl)aniline
CID 64751764
2-(diethylaminomethyl)-N-(oxan-4-ylmethyl)aniline
CID 62386684
tert-butyl N-methyl-N-[[2-(oxolan-3-ylamino)phenyl]methyl]carbamate
CID 103892825
N-(2-ethylsulfanylphenyl)oxolan-3-amine
CID 63335369
2-(diethylaminomethyl)-N-(2,6-dimethylcyclohexyl)aniline
CID 43729304
N-(1-cyclopentylethyl)-2-(diethylaminomethyl)aniline
CID 62633352
N-(2-fluorophenyl)oxolan-3-amine
CID 63332099
N-(2-methoxyphenyl)oxolan-3-amine
CID 14978001
N-[[2-(2,2-diethylhydrazinyl)phenyl]methyl]-N-ethylethanamine
CID 101120062
2-(oxolan-3-ylamino)-N-propylbenzenesulfonamide
CID 80713071
2-(diethylaminomethyl)-N-methylaniline
CID 23009383

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine?
The IUPAC name of N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine (CID 63335462) is N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine.
What is the SMILES notation for N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine?
The canonical SMILES for N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine is CCN(CC)Cc1ccccc1NC1CCOC1.
What is the InChIKey of N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine?
The InChIKey is CLZFMNNRONLNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-17(4-2)11-13-7-5-6-8-15(13)16-14-9-10-18-12-14/h5-8,14,16H,3-4,9-12H2,1-2H3.
What are the key properties of N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine?
N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine has a molecular weight of 248.37 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylaminomethyl)phenyl]oxolan-3-amine is sourced from PubChem (CID 63335462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).