5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one

C10H17N3O3 — CID 114398200

IUPAC5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one
SMILESNCC1CN(C(=O)C2CCC(=O)N2)CCO1
InChIInChI=1S/C10H17N3O3/c11-5-7-6-13(3-4-16-7)10(15)8-1-2-9(14)12-8/h7-8H,1-6,11H2,(H,12,14)
InChIKeyYKFPTQZJNWRVRR-UHFFFAOYSA-N
MW227.26 g/mol
LogP-1.55
Rot. Bonds2

About 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one

5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one (PubChem CID 114398200) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one.

Molecular Properties

Compound Name5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one
PubChem CID114398200
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one
SMILESNCC1CN(C(=O)C2CCC(=O)N2)CCO1
InChIInChI=1S/C10H17N3O3/c11-5-7-6-13(3-4-16-7)10(15)8-1-2-9(14)12-8/h7-8H,1-6,11H2,(H,12,14)
InChIKeyYKFPTQZJNWRVRR-UHFFFAOYSA-N
XLogP-1.55
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-1.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[2-(cyclopropylmethoxymethyl)morpholine-4-carbonyl]pyrrolidin-2-one
CID 127935355
5-[2-(2-phenylethyl)morpholine-4-carbonyl]pyrrolidin-2-one
CID 110740938
5-(1,3-oxazolidine-3-carbonyl)pyrrolidin-2-one
CID 110746563
[2-(aminomethyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-2-yl)methanone
CID 106892186
methyl 2-[4-(6-oxopiperidine-3-carbonyl)morpholin-2-yl]acetate
CID 79807210
(5R)-5-(pyrrolidine-1-carbonyl)pyrrolidin-2-one
CID 45116190
5-(4-aminopiperidine-1-carbonyl)pyrrolidin-2-one
CID 43556218
(5R)-5-(3-hydroxyazetidine-1-carbonyl)pyrrolidin-2-one
CID 103782617
1-(5-oxopyrrolidine-2-carbonyl)piperidine-3,4-dicarboxylic acid
CID 115918284
2-(aminomethyl)-N-ethylmorpholine-4-carboxamide
CID 61337795
(5R)-5-(3-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 103806957
[2-(aminomethyl)morpholin-4-yl]-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone
CID 62718398

Frequently Asked Questions

What is the IUPAC name of 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one?
The IUPAC name of 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one (CID 114398200) is 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one.
What is the SMILES notation for 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one?
The canonical SMILES for 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one is NCC1CN(C(=O)C2CCC(=O)N2)CCO1.
What is the InChIKey of 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one?
The InChIKey is YKFPTQZJNWRVRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c11-5-7-6-13(3-4-16-7)10(15)8-1-2-9(14)12-8/h7-8H,1-6,11H2,(H,12,14).
What are the key properties of 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one?
5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one has a molecular weight of 227.26 g/mol, XLogP of -1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(aminomethyl)morpholine-4-carbonyl]pyrrolidin-2-one is sourced from PubChem (CID 114398200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).