2-methyl-4-pyrrolidin-3-ylmorpholine

C9H18N2O — CID 62329456

IUPAC2-methyl-4-pyrrolidin-3-ylmorpholine
SMILESCC1CN(C2CCNC2)CCO1
InChIInChI=1S/C9H18N2O/c1-8-7-11(4-5-12-8)9-2-3-10-6-9/h8-10H,2-7H2,1H3
InChIKeyLCKBFIFUPGWEMQ-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.07
Rot. Bonds1

About 2-methyl-4-pyrrolidin-3-ylmorpholine

2-methyl-4-pyrrolidin-3-ylmorpholine (PubChem CID 62329456) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2-methyl-4-pyrrolidin-3-ylmorpholine.

Molecular Properties

Compound Name2-methyl-4-pyrrolidin-3-ylmorpholine
PubChem CID62329456
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2-methyl-4-pyrrolidin-3-ylmorpholine
SMILESCC1CN(C2CCNC2)CCO1
InChIInChI=1S/C9H18N2O/c1-8-7-11(4-5-12-8)9-2-3-10-6-9/h8-10H,2-7H2,1H3
InChIKeyLCKBFIFUPGWEMQ-UHFFFAOYSA-N
XLogP0.07
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(Pyrrolidin-2-ylmethyl)morpholine
CID 4715221
4-(Pyrrolidin-3-yl)morpholine
CID 14627373
2-(2,5-Dimethylmorpholin-4-yl)ethan-1-amine
CID 43544264
4-(Pyrrolidin-3-yl)morpholine dihydrochloride
CID 53409900
4-(Pyrrolidin-3-yl)morpholine hydrochloride
CID 53442929
2-(Piperazin-1-ylmethyl)-4-(propan-2-yl)morpholine
CID 54592597
Methyl[1-(morpholin-4-yl)propan-2-yl]amine
CID 61501008
4-Methoxy-1-(pyrrolidin-3-yl)piperidine
CID 62327575
rac-(4aR,7aS)-4-methyl-octahydropyrrolo(3,4-b)morpholine
CID 68019343
1-(4-Methylmorpholin-2-yl)ethan-1-amine
CID 68190774
rac-(4aR,7aS)-6-methyl-octahydropyrrolo[3,4-b][1,4]oxazine
CID 68271608
Morpholine, 4-(4-methyl-3-pyrrolidinyl)-
CID 73994640

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-pyrrolidin-3-ylmorpholine?
The IUPAC name of 2-methyl-4-pyrrolidin-3-ylmorpholine (CID 62329456) is 2-methyl-4-pyrrolidin-3-ylmorpholine.
What is the SMILES notation for 2-methyl-4-pyrrolidin-3-ylmorpholine?
The canonical SMILES for 2-methyl-4-pyrrolidin-3-ylmorpholine is CC1CN(C2CCNC2)CCO1.
What is the InChIKey of 2-methyl-4-pyrrolidin-3-ylmorpholine?
The InChIKey is LCKBFIFUPGWEMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-8-7-11(4-5-12-8)9-2-3-10-6-9/h8-10H,2-7H2,1H3.
What are the key properties of 2-methyl-4-pyrrolidin-3-ylmorpholine?
2-methyl-4-pyrrolidin-3-ylmorpholine has a molecular weight of 170.26 g/mol, XLogP of 0.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-pyrrolidin-3-ylmorpholine is sourced from PubChem (CID 62329456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).