1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile

C15H25N3O — CID 79638552

IUPAC1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile
SMILESCCC1COCCN1C1CCC(C#N)(NC2CC2)C1
InChIInChI=1S/C15H25N3O/c1-2-13-10-19-8-7-18(13)14-5-6-15(9-14,11-16)17-12-3-4-12/h12-14,17H,2-10H2,1H3
InChIKeyGAYLOJDQWCHRFT-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.66
Rot. Bonds4

About 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile

1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile (PubChem CID 79638552) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile
PubChem CID79638552
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile
SMILESCCC1COCCN1C1CCC(C#N)(NC2CC2)C1
InChIInChI=1S/C15H25N3O/c1-2-13-10-19-8-7-18(13)14-5-6-15(9-14,11-16)17-12-3-4-12/h12-14,17H,2-10H2,1H3
InChIKeyGAYLOJDQWCHRFT-UHFFFAOYSA-N
XLogP1.66
TPSA48.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;3-ethyl-4-(oxetan-3-yl)morpholine
CID 177200740
1-(ethylamino)-3-(3-methylmorpholin-4-yl)cyclohexane-1-carbonitrile
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1-(cyclopropylamino)-3-piperidin-1-ylcyclopentane-1-carbonitrile
CID 79639135
1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile
CID 64513094
1-(ethylamino)-3-(5-ethyl-2-methylmorpholin-4-yl)cyclopentane-1-carbonitrile
CID 79639950
1-(cyclopropylamino)-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]cyclopentane-1-carbonitrile
CID 104960154
1-(cyclopropylamino)-3-(4-propan-2-ylpiperazin-1-yl)cyclopentane-1-carbonitrile
CID 79639574
1-(cyclopropylamino)-3-(3,4-dimethoxypyrrolidin-1-yl)cyclopentane-1-carbonitrile
CID 103537863
methyl 3-(3-ethylmorpholin-4-yl)-1-(propan-2-ylamino)cyclopentane-1-carboxylate
CID 79645895
ethyl 1-(ethylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carboxylate
CID 79645896
1-(cyclopropylamino)-3-(3,4-dimethylpiperazin-1-yl)cyclopentane-1-carbonitrile
CID 79638318
1-(cyclopropylamino)-3-(3-propoxypiperidin-1-yl)cyclopentane-1-carbonitrile
CID 79639825

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile?
The IUPAC name of 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile (CID 79638552) is 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile?
The canonical SMILES for 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile is CCC1COCCN1C1CCC(C#N)(NC2CC2)C1.
What is the InChIKey of 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile?
The InChIKey is GAYLOJDQWCHRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-2-13-10-19-8-7-18(13)14-5-6-15(9-14,11-16)17-12-3-4-12/h12-14,17H,2-10H2,1H3.
What are the key properties of 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile?
1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile has a molecular weight of 263.38 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile is sourced from PubChem (CID 79638552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).