1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one

C15H24N2O2 — CID 137449049

IUPAC1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one
SMILESCOC1CCC(n2cccc(NC(C)C)c2=O)CC1
InChIInChI=1S/C15H24N2O2/c1-11(2)16-14-5-4-10-17(15(14)18)12-6-8-13(19-3)9-7-12/h4-5,10-13,16H,6-9H2,1-3H3
InChIKeyCOZQZXRIXRYLGP-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.80
Rot. Bonds4

About 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one

1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one (PubChem CID 137449049) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one.

Molecular Properties

Compound Name1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one
PubChem CID137449049
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one
SMILESCOC1CCC(n2cccc(NC(C)C)c2=O)CC1
InChIInChI=1S/C15H24N2O2/c1-11(2)16-14-5-4-10-17(15(14)18)12-6-8-13(19-3)9-7-12/h4-5,10-13,16H,6-9H2,1-3H3
InChIKeyCOZQZXRIXRYLGP-UHFFFAOYSA-N
XLogP2.80
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1R,3R)-3-methoxycyclohexyl]-3-(propan-2-ylamino)pyridin-2-one
CID 137457664
1-(4-morpholin-4-ylcyclohexyl)-3-(propan-2-ylamino)pyridin-2-one
CID 137457478
1-[(1S,2S)-2-methoxycyclopropyl]-3-(propan-2-ylamino)pyridin-2-one
CID 137457494
1-[(1S,2R)-2-hydroxycyclopentyl]-3-(propan-2-ylamino)pyridin-2-one
CID 139373552
1-[(1R,3S)-3-hydroxycyclohexyl]-3-(propan-2-ylamino)pyridin-2-one
CID 139373382
1-(oxan-3-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 139383698
1-(4-hydroxycyclohexyl)-3-(methylamino)pyridin-2-one
CID 137449098
tert-butyl N-[1-(4-methoxycyclohexyl)-2-oxo-3-pyridinyl]-N-methylcarbamate
CID 146560509
5-[[1-(4-methoxycyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 142523721
1-(2-methoxyethyl)-3-(propan-2-ylamino)pyridin-2-one
CID 139373358
methyl 1-cyclobutyl-2-oxopyridine-3-carboxylate
CID 139390457
methyl 1-(3-methoxycyclohexyl)-2-oxopyridine-3-carboxylate
CID 137449925

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one?
The IUPAC name of 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one (CID 137449049) is 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one.
What is the SMILES notation for 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one?
The canonical SMILES for 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one is COC1CCC(n2cccc(NC(C)C)c2=O)CC1.
What is the InChIKey of 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one?
The InChIKey is COZQZXRIXRYLGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)16-14-5-4-10-17(15(14)18)12-6-8-13(19-3)9-7-12/h4-5,10-13,16H,6-9H2,1-3H3.
What are the key properties of 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one?
1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one has a molecular weight of 264.37 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one is sourced from PubChem (CID 137449049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).