N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine

C15H24N2O — CID 43542425

IUPACN-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine
SMILESCC(C)NCc1ccccc1N1CCOCC1C
InChIInChI=1S/C15H24N2O/c1-12(2)16-10-14-6-4-5-7-15(14)17-8-9-18-11-13(17)3/h4-7,12-13,16H,8-11H2,1-3H3
InChIKeyHKFBWUSTGYBPCC-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.41
Rot. Bonds4

About N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine

N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine (PubChem CID 43542425) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine
PubChem CID43542425
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine
SMILESCC(C)NCc1ccccc1N1CCOCC1C
InChIInChI=1S/C15H24N2O/c1-12(2)16-10-14-6-4-5-7-15(14)17-8-9-18-11-13(17)3/h4-7,12-13,16H,8-11H2,1-3H3
InChIKeyHKFBWUSTGYBPCC-UHFFFAOYSA-N
XLogP2.41
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 ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]ethanamine
CID 43542427
N-[[2-(3-methylmorpholin-4-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62281138
N-[[2-(2,4-dimethylpiperidin-1-yl)phenyl]methyl]propan-2-amine
CID 62331056
N-[[6-(3-methylmorpholin-4-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62280987
N-[[3-fluoro-4-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine
CID 43542420
N-[1-[2-(3-methylmorpholin-4-yl)phenyl]ethyl]propan-1-amine
CID 43542240
1-[2-(3-methylmorpholin-4-yl)phenyl]ethanol
CID 43542345
N-[[5-(3-methylmorpholin-4-yl)pyrazin-2-yl]methyl]propan-2-amine
CID 107379181
N-[(2-piperidin-1-ylphenyl)methyl]propan-2-amine
CID 43213770
N-[[2-(azepan-1-yl)phenyl]methyl]propan-2-amine
CID 43280522
N-[[2-(2,3,5-trimethylpiperidin-1-yl)phenyl]methyl]propan-2-amine
CID 114594233
N-[[2-(2-ethylazepan-1-yl)phenyl]methyl]propan-2-amine
CID 104690764

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine?
The IUPAC name of N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine (CID 43542425) is N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine is CC(C)NCc1ccccc1N1CCOCC1C.
What is the InChIKey of N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine?
The InChIKey is HKFBWUSTGYBPCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12(2)16-10-14-6-4-5-7-15(14)17-8-9-18-11-13(17)3/h4-7,12-13,16H,8-11H2,1-3H3.
What are the key properties of N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine?
N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine has a molecular weight of 248.37 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine is sourced from PubChem (CID 43542425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).