5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one

C14H22N2O2 — CID 43733481

IUPAC5-(cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one
SMILESCOCCN1C=C(C=CC1=O)NC2CCCCC2
InChIInChI=1S/C14H22N2O2/c1-18-10-9-16-11-13(7-8-14(16)17)15-12-5-3-2-4-6-12/h7-8,11-12,15H,2-6,9-10H2,1H3
InChIKeyBGVPBGFJYRXEGH-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.80
Rot. Bonds5

About 5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one

5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one (PubChem CID 43733481) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 5-(cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one.

Molecular Properties

Compound Name5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one
PubChem CID43733481
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name5-(cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one
SMILESCOCCN1C=C(C=CC1=O)NC2CCCCC2
InChIInChI=1S/C14H22N2O2/c1-18-10-9-16-11-13(7-8-14(16)17)15-12-5-3-2-4-6-12/h7-8,11-12,15H,2-6,9-10H2,1H3
InChIKeyBGVPBGFJYRXEGH-UHFFFAOYSA-N
XLogP1.80
TPSA41.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity344

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one?
The IUPAC name of 5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one (CID 43733481) is 5-(cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one.
What is the SMILES notation for 5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one?
The canonical SMILES for 5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one is COCCN1C=C(C=CC1=O)NC2CCCCC2.
What is the InChIKey of 5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one?
The InChIKey is BGVPBGFJYRXEGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-18-10-9-16-11-13(7-8-14(16)17)15-12-5-3-2-4-6-12/h7-8,11-12,15H,2-6,9-10H2,1H3.
What are the key properties of 5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one?
5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one has a molecular weight of 250.34 g/mol, XLogP of 1.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(Cyclohexylamino)-1-(2-methoxyethyl)pyridin-2-one is sourced from PubChem (CID 43733481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).