N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine

C13H24N2O2 — CID 113370614

IUPACN-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine
SMILESCCNC(C1=COCCC1)C1CN(C)CCO1
InChIInChI=1S/C13H24N2O2/c1-3-14-13(11-5-4-7-16-10-11)12-9-15(2)6-8-17-12/h10,12-14H,3-9H2,1-2H3
InChIKeyPGGFBVBPIVELPQ-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.99
Rot. Bonds4

About N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine

N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine (PubChem CID 113370614) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine
PubChem CID113370614
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine
SMILESCCNC(C1=COCCC1)C1CN(C)CCO1
InChIInChI=1S/C13H24N2O2/c1-3-14-13(11-5-4-7-16-10-11)12-9-15(2)6-8-17-12/h10,12-14H,3-9H2,1-2H3
InChIKeyPGGFBVBPIVELPQ-UHFFFAOYSA-N
XLogP0.99
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-methylmorpholin-2-yl)-naphthalen-1-ylmethyl]ethanamine
CID 79095140
N-[furan-3-yl-(4-methylmorpholin-2-yl)methyl]ethanamine
CID 79093754
N-[(2,3-dichlorophenyl)-(4-methylmorpholin-2-yl)methyl]ethanamine
CID 79093846
N-[(4-methylmorpholin-2-yl)-(3-propyltriazol-4-yl)methyl]ethanamine
CID 114688442
N-[(4-methylmorpholin-2-yl)-quinolin-8-ylmethyl]ethanamine
CID 81229496
N-ethyl-2-(4-ethylphenyl)-1-(4-methylmorpholin-2-yl)ethanamine
CID 79093945
N-[(4-chloro-1-ethylpyrazol-5-yl)-(4-methylmorpholin-2-yl)methyl]ethanamine
CID 114657208
N-[(4-chloro-1-propylpyrazol-5-yl)-(4-methylmorpholin-2-yl)methyl]ethanamine
CID 114657209
[cycloocten-1-yl-(4-methylmorpholin-2-yl)methyl]hydrazine
CID 106649233
N-ethyl-1-(4-methylmorpholin-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 79093263
N-ethyl-2-(1-methylimidazol-2-yl)-1-(4-methylmorpholin-2-yl)ethanamine
CID 79761166
N-[(2-ethylcyclohexyl)-(4-methylmorpholin-2-yl)methyl]ethanamine
CID 79093457

Frequently Asked Questions

What is the IUPAC name of N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine?
The IUPAC name of N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine (CID 113370614) is N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine?
The canonical SMILES for N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine is CCNC(C1=COCCC1)C1CN(C)CCO1.
What is the InChIKey of N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine?
The InChIKey is PGGFBVBPIVELPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-3-14-13(11-5-4-7-16-10-11)12-9-15(2)6-8-17-12/h10,12-14H,3-9H2,1-2H3.
What are the key properties of N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine?
N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine has a molecular weight of 240.35 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3,4-dihydro-2H-pyran-5-yl-(4-methylmorpholin-2-yl)methyl]ethanamine is sourced from PubChem (CID 113370614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).