5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one

C12H22N2O2 — CID 115060442

IUPAC5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one
SMILESNCCCC1COCC(=O)N1C1CCCC1
InChIInChI=1S/C12H22N2O2/c13-7-3-6-11-8-16-9-12(15)14(11)10-4-1-2-5-10/h10-11H,1-9,13H2
InChIKeyJUDQACMNPVPZTC-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.90
Rot. Bonds4

About 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one

5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one (PubChem CID 115060442) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one.

Molecular Properties

Compound Name5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one
PubChem CID115060442
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one
SMILESNCCCC1COCC(=O)N1C1CCCC1
InChIInChI=1S/C12H22N2O2/c13-7-3-6-11-8-16-9-12(15)14(11)10-4-1-2-5-10/h10-11H,1-9,13H2
InChIKeyJUDQACMNPVPZTC-UHFFFAOYSA-N
XLogP0.90
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid
CID 115060435
5-(aminomethyl)-4-(1-methylpiperidin-3-yl)morpholin-3-one
CID 115102651
5-(3-aminopropyl)-4-benzylmorpholin-3-one
CID 115060565
5-(3-aminopropyl)-4-(4-hydroxyphenyl)morpholin-3-one
CID 115060512
4-(1,1-dioxothiolan-3-yl)-5-(2-hydroxyethyl)morpholin-3-one
CID 117009620
5-(aminomethyl)-4-(thian-2-yl)morpholin-3-one
CID 115102691
5-(aminomethyl)-4-(1-methylpyrrolidin-3-yl)morpholin-3-one
CID 115102568
5-(hydroxymethyl)-4-(thian-4-yl)morpholin-3-one
CID 115102593
5-(3-aminopropyl)-4-(2-chlorophenyl)morpholin-3-one
CID 115060484
4-(1-ethylpiperidin-3-yl)-5-(hydroxymethyl)morpholin-3-one
CID 115102659
6-(hydroxymethyl)-6,7,8,8a-tetrahydro-1H-pyrrolo[2,1-c][1,4]oxazin-4-one
CID 164875999
5-(3-aminopropyl)-4-[(2-methylphenyl)methyl]morpholin-3-one
CID 115060596

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one?
The IUPAC name of 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one (CID 115060442) is 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one.
What is the SMILES notation for 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one?
The canonical SMILES for 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one is NCCCC1COCC(=O)N1C1CCCC1.
What is the InChIKey of 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one?
The InChIKey is JUDQACMNPVPZTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c13-7-3-6-11-8-16-9-12(15)14(11)10-4-1-2-5-10/h10-11H,1-9,13H2.
What are the key properties of 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one?
5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one has a molecular weight of 226.32 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one is sourced from PubChem (CID 115060442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).