5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one

C15H24N2O2 — CID 54863757

IUPAC5-[(2-methoxycyclohexyl)amino]-1-propylpyridin-2-one
SMILESCCCN1C=C(C=CC1=O)NC2CCCCC2OC
InChIInChI=1S/C15H24N2O2/c1-3-10-17-11-12(8-9-15(17)18)16-13-6-4-5-7-14(13)19-2/h8-9,11,13-14,16H,3-7,10H2,1-2H3
InChIKeyYLXHMGUMTATOGV-UHFFFAOYSA-N
MW264.36 g/mol
LogP2.20
Rot. Bonds5

About 5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one

5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one (PubChem CID 54863757) has the molecular formula C15H24N2O2 and a molecular weight of 264.36 g/mol. Its IUPAC name is 5-[(2-methoxycyclohexyl)amino]-1-propylpyridin-2-one.

Molecular Properties

Compound Name5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one
PubChem CID54863757
Molecular FormulaC15H24N2O2
Molecular Weight264.36 g/mol
Exact Mass264.18
IUPAC Name5-[(2-methoxycyclohexyl)amino]-1-propylpyridin-2-one
SMILESCCCN1C=C(C=CC1=O)NC2CCCCC2OC
InChIInChI=1S/C15H24N2O2/c1-3-10-17-11-12(8-9-15(17)18)16-13-6-4-5-7-14(13)19-2/h8-9,11,13-14,16H,3-7,10H2,1-2H3
InChIKeyYLXHMGUMTATOGV-UHFFFAOYSA-N
XLogP2.20
TPSA41.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity376

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.36
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one?
The IUPAC name of 5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one (CID 54863757) is 5-[(2-methoxycyclohexyl)amino]-1-propylpyridin-2-one.
What is the SMILES notation for 5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one?
The canonical SMILES for 5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one is CCCN1C=C(C=CC1=O)NC2CCCCC2OC.
What is the InChIKey of 5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one?
The InChIKey is YLXHMGUMTATOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-10-17-11-12(8-9-15(17)18)16-13-6-4-5-7-14(13)19-2/h8-9,11,13-14,16H,3-7,10H2,1-2H3.
What are the key properties of 5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one?
5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one has a molecular weight of 264.36 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-Methoxycyclohexyl)amino]-1-propylpyridin-2-one is sourced from PubChem (CID 54863757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).