2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one

C15H28N2O2 — CID 91644816

IUPAC2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one
SMILESCCC(NC(C)C1CCCC1)C(=O)N1CCOCC1
InChIInChI=1S/C15H28N2O2/c1-3-14(15(18)17-8-10-19-11-9-17)16-12(2)13-6-4-5-7-13/h12-14,16H,3-11H2,1-2H3
InChIKeyOXUDBHJOTLWNNF-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.79
Rot. Bonds5

About 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one

2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one (PubChem CID 91644816) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one.

Molecular Properties

Compound Name2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one
PubChem CID91644816
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one
SMILESCCC(NC(C)C1CCCC1)C(=O)N1CCOCC1
InChIInChI=1S/C15H28N2O2/c1-3-14(15(18)17-8-10-19-11-9-17)16-12(2)13-6-4-5-7-13/h12-14,16H,3-11H2,1-2H3
InChIKeyOXUDBHJOTLWNNF-UHFFFAOYSA-N
XLogP1.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-{1-[(2-methoxyethyl)amino]-3-methyl-1-oxobutan-2-yl}cyclohexanecarboxamide
CID 4191585
LM11A-31
CID 18604758
2-amino-3-methyl-N-[2-(morpholin-4-yl)ethyl]pentanamide
CID 11959372
4-methyl-N-(3-methyl-1-{[3-(morpholin-4-yl)propyl]amino}-1-oxobutan-2-yl)cyclohexanecarboxamide
CID 3243058
2-Propyl-pentanoic acid (2-morpholin-4-yl-ethyl)-amide
CID 6602917
N~2~-[(4-methylcyclohexyl)carbonyl]-N-[2-(morpholin-4-yl)ethyl]leucinamide
CID 16478659
2-Amino-4-methyl-1-(morpholin-4-YL)pentan-1-one
CID 21355341
4-Morpholineacetamide, N-(1-ethyl-1-methylpentyl)-, hydrochloride
CID 3066364
2-amino-3-methyl-N-(2-morpholin-4-ylethyl)pentanamide dihydrochloride
CID 43810708
(2S)-2-amino-3-methyl-1-(morpholin-4-yl)butan-1-one
CID 14963842
N-[2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-oxoethyl]cyclohexanecarboxamide
CID 25163204
N-(1-methoxypropan-2-yl)-2-(4-methylpiperidin-1-yl)acetamide
CID 45796799

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one?
The IUPAC name of 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one (CID 91644816) is 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one.
What is the SMILES notation for 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one?
The canonical SMILES for 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one is CCC(NC(C)C1CCCC1)C(=O)N1CCOCC1.
What is the InChIKey of 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one?
The InChIKey is OXUDBHJOTLWNNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-14(15(18)17-8-10-19-11-9-17)16-12(2)13-6-4-5-7-13/h12-14,16H,3-11H2,1-2H3.
What are the key properties of 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one?
2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one has a molecular weight of 268.40 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylethylamino)-1-morpholin-4-ylbutan-1-one is sourced from PubChem (CID 91644816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).