[1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine

C12H25N3O — CID 143730698

IUPAC[1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine
SMILESCC1CNCC(CCN2CCCC2CN)O1
InChIInChI=1S/C12H25N3O/c1-10-8-14-9-12(16-10)4-6-15-5-2-3-11(15)7-13/h10-12,14H,2-9,13H2,1H3
InChIKeyXDBYHTZOBMHGCT-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.18
Rot. Bonds4

About [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine

[1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine (PubChem CID 143730698) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine
PubChem CID143730698
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name[1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine
SMILESCC1CNCC(CCN2CCCC2CN)O1
InChIInChI=1S/C12H25N3O/c1-10-8-14-9-12(16-10)4-6-15-5-2-3-11(15)7-13/h10-12,14H,2-9,13H2,1H3
InChIKeyXDBYHTZOBMHGCT-UHFFFAOYSA-N
XLogP0.18
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine?
The IUPAC name of [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine (CID 143730698) is [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine?
The canonical SMILES for [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine is CC1CNCC(CCN2CCCC2CN)O1.
What is the InChIKey of [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine?
The InChIKey is XDBYHTZOBMHGCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-10-8-14-9-12(16-10)4-6-15-5-2-3-11(15)7-13/h10-12,14H,2-9,13H2,1H3.
What are the key properties of [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine?
[1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine has a molecular weight of 227.35 g/mol, XLogP of 0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(6-methylmorpholin-2-yl)ethyl]pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 143730698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).