1-morpholin-4-ylcyclopentane-1-carbonitrile

C10H16N2O — CID 16644595

IUPAC1-morpholin-4-ylcyclopentane-1-carbonitrile
SMILESN#CC1(N2CCOCC2)CCCC1
InChIInChI=1S/C10H16N2O/c11-9-10(3-1-2-4-10)12-5-7-13-8-6-12/h1-8H2
InChIKeyFKGGDZUTOZLKTF-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.15
Rot. Bonds1

About 1-morpholin-4-ylcyclopentane-1-carbonitrile

1-morpholin-4-ylcyclopentane-1-carbonitrile (PubChem CID 16644595) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 1-morpholin-4-ylcyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-morpholin-4-ylcyclopentane-1-carbonitrile
PubChem CID16644595
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name1-morpholin-4-ylcyclopentane-1-carbonitrile
SMILESN#CC1(N2CCOCC2)CCCC1
InChIInChI=1S/C10H16N2O/c11-9-10(3-1-2-4-10)12-5-7-13-8-6-12/h1-8H2
InChIKeyFKGGDZUTOZLKTF-UHFFFAOYSA-N
XLogP1.15
TPSA36.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-ylcyclopentane-1-carbonitrile?
The IUPAC name of 1-morpholin-4-ylcyclopentane-1-carbonitrile (CID 16644595) is 1-morpholin-4-ylcyclopentane-1-carbonitrile.
What is the SMILES notation for 1-morpholin-4-ylcyclopentane-1-carbonitrile?
The canonical SMILES for 1-morpholin-4-ylcyclopentane-1-carbonitrile is N#CC1(N2CCOCC2)CCCC1.
What is the InChIKey of 1-morpholin-4-ylcyclopentane-1-carbonitrile?
The InChIKey is FKGGDZUTOZLKTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c11-9-10(3-1-2-4-10)12-5-7-13-8-6-12/h1-8H2.
What are the key properties of 1-morpholin-4-ylcyclopentane-1-carbonitrile?
1-morpholin-4-ylcyclopentane-1-carbonitrile has a molecular weight of 180.25 g/mol, XLogP of 1.15, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-ylcyclopentane-1-carbonitrile is sourced from PubChem (CID 16644595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).