N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine

C13H26N2O2 — CID 82834990

IUPACN-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine
SMILESCC(CN1CCOCC1)NCC1CCC(C)O1
InChIInChI=1S/C13H26N2O2/c1-11(10-15-5-7-16-8-6-15)14-9-13-4-3-12(2)17-13/h11-14H,3-10H2,1-2H3
InChIKeyKIQUAFRQUJWOIA-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.86
Rot. Bonds5

About N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine

N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine (PubChem CID 82834990) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine
PubChem CID82834990
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine
SMILESCC(CN1CCOCC1)NCC1CCC(C)O1
InChIInChI=1S/C13H26N2O2/c1-11(10-15-5-7-16-8-6-15)14-9-13-4-3-12(2)17-13/h11-14H,3-10H2,1-2H3
InChIKeyKIQUAFRQUJWOIA-UHFFFAOYSA-N
XLogP0.86
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The IUPAC name of N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine (CID 82834990) is N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine.
What is the SMILES notation for N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The canonical SMILES for N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine is CC(CN1CCOCC1)NCC1CCC(C)O1.
What is the InChIKey of N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The InChIKey is KIQUAFRQUJWOIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-11(10-15-5-7-16-8-6-15)14-9-13-4-3-12(2)17-13/h11-14H,3-10H2,1-2H3.
What are the key properties of N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine has a molecular weight of 242.36 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine is sourced from PubChem (CID 82834990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).