1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile

C15H27N3O — CID 79639950

IUPAC1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile
SMILESCCNC1(C#N)CCC(N2CC(C)OCC2CC)C1
InChIInChI=1S/C15H27N3O/c1-4-13-10-19-12(3)9-18(13)14-6-7-15(8-14,11-16)17-5-2/h12-14,17H,4-10H2,1-3H3
InChIKeyVIGDBGKYSFMZOB-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.91
Rot. Bonds4

About 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile

1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile (PubChem CID 79639950) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile
PubChem CID79639950
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile
SMILESCCNC1(C#N)CCC(N2CC(C)OCC2CC)C1
InChIInChI=1S/C15H27N3O/c1-4-13-10-19-12(3)9-18(13)14-6-7-15(8-14,11-16)17-5-2/h12-14,17H,4-10H2,1-3H3
InChIKeyVIGDBGKYSFMZOB-UHFFFAOYSA-N
XLogP1.91
TPSA48.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,5-dimethylmorpholin-4-yl)-1-(ethylamino)cyclopentane-1-carbonitrile
CID 79639476
1-(ethylamino)-3-(3-methylmorpholin-4-yl)cyclohexane-1-carbonitrile
CID 79625720
3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-(ethylamino)cyclohexane-1-carbonitrile
CID 104960172
3-(4,4-dimethylazepan-1-yl)-1-(ethylamino)cyclopentane-1-carbonitrile
CID 79639514
1-(ethylamino)-3-(2-ethyl-5-methylpyrrolidin-1-yl)cyclohexane-1-carbonitrile
CID 83221342
1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile
CID 79638552
1-(ethylamino)-3-(3-phenylpyrrolidin-1-yl)cyclopentane-1-carbonitrile
CID 79639357
3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1-(ethylamino)cyclopentane-1-carbonitrile
CID 79935897
1-(ethylamino)-3-(4-ethylazepan-1-yl)cyclopentane-1-carbonitrile
CID 79638583
3-(2,4-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexane-1-carbonitrile
CID 79625508
3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-1-(ethylamino)cyclohexane-1-carbonitrile
CID 115561389
1-(propylamino)-3-(2,3,5-trimethylpiperidin-1-yl)cyclopentane-1-carbonitrile
CID 114596275

Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile?
The IUPAC name of 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile (CID 79639950) is 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile?
The canonical SMILES for 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile is CCNC1(C#N)CCC(N2CC(C)OCC2CC)C1.
What is the InChIKey of 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile?
The InChIKey is VIGDBGKYSFMZOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-4-13-10-19-12(3)9-18(13)14-6-7-15(8-14,11-16)17-5-2/h12-14,17H,4-10H2,1-3H3.
What are the key properties of 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile?
1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile has a molecular weight of 265.40 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile is sourced from PubChem (CID 79639950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).