5-amino-1-morpholin-4-ylpentan-1-one

C9H18N2O2 — CID 54404632

IUPAC5-amino-1-morpholin-4-ylpentan-1-one
SMILESNCCCCC(=O)N1CCOCC1
InChIInChI=1S/C9H18N2O2/c10-4-2-1-3-9(12)11-5-7-13-8-6-11/h1-8,10H2
InChIKeyJLYQPDFMLOFEFU-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.03
Rot. Bonds4

About 5-amino-1-morpholin-4-ylpentan-1-one

5-amino-1-morpholin-4-ylpentan-1-one (PubChem CID 54404632) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 5-amino-1-morpholin-4-ylpentan-1-one.

Molecular Properties

Compound Name5-amino-1-morpholin-4-ylpentan-1-one
PubChem CID54404632
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name5-amino-1-morpholin-4-ylpentan-1-one
SMILESNCCCCC(=O)N1CCOCC1
InChIInChI=1S/C9H18N2O2/c10-4-2-1-3-9(12)11-5-7-13-8-6-11/h1-8,10H2
InChIKeyJLYQPDFMLOFEFU-UHFFFAOYSA-N
XLogP-0.03
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)hexan-1-one
CID 4861310
7-amino-1-(1,4-oxazepan-4-yl)heptan-1-one
CID 62973457
5-morpholin-4-yl-5-oxopentanamide
CID 135345694
5-hydroxy-1-morpholin-4-ylpentan-1-one
CID 54520383
7-amino-1-[4-(morpholin-4-ylmethyl)piperidin-1-yl]heptan-1-one
CID 119851740
7-amino-1-pyrrolidin-1-ylheptan-1-one
CID 24707646
ethane;1-morpholin-4-ylhexan-1-one
CID 143214280
1-morpholin-4-ylheptan-1-one;hydrochloride
CID 175124060
7-amino-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]heptan-1-one;hydrochloride
CID 119700490
methyl 6-[16-(6-methoxy-6-oxohexanoyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]-6-oxohexanoate
CID 4584644
6-(azepan-1-yl)-6-oxohexanamide;hexane-1,6-diamine
CID 174378277
5-amino-1-[2-(hydroxymethyl)morpholin-4-yl]pentan-1-one
CID 81202936

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-morpholin-4-ylpentan-1-one?
The IUPAC name of 5-amino-1-morpholin-4-ylpentan-1-one (CID 54404632) is 5-amino-1-morpholin-4-ylpentan-1-one.
What is the SMILES notation for 5-amino-1-morpholin-4-ylpentan-1-one?
The canonical SMILES for 5-amino-1-morpholin-4-ylpentan-1-one is NCCCCC(=O)N1CCOCC1.
What is the InChIKey of 5-amino-1-morpholin-4-ylpentan-1-one?
The InChIKey is JLYQPDFMLOFEFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c10-4-2-1-3-9(12)11-5-7-13-8-6-11/h1-8,10H2.
What are the key properties of 5-amino-1-morpholin-4-ylpentan-1-one?
5-amino-1-morpholin-4-ylpentan-1-one has a molecular weight of 186.25 g/mol, XLogP of -0.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-morpholin-4-ylpentan-1-one is sourced from PubChem (CID 54404632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).