2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one

C15H23N3O2 — CID 136822014

IUPAC2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
SMILESCC1(C)CN(c2cc(=O)[nH]c(C3CC3)n2)CC(C)(C)O1
InChIInChI=1S/C15H23N3O2/c1-14(2)8-18(9-15(3,4)20-14)11-7-12(19)17-13(16-11)10-5-6-10/h7,10H,5-6,8-9H2,1-4H3,(H,16,17,19)
InChIKeyQCAFNCITTCJWMA-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.04
Rot. Bonds2

About 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one

2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one (PubChem CID 136822014) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
PubChem CID136822014
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
SMILESCC1(C)CN(c2cc(=O)[nH]c(C3CC3)n2)CC(C)(C)O1
InChIInChI=1S/C15H23N3O2/c1-14(2)8-18(9-15(3,4)20-14)11-7-12(19)17-13(16-11)10-5-6-10/h7,10H,5-6,8-9H2,1-4H3,(H,16,17,19)
InChIKeyQCAFNCITTCJWMA-UHFFFAOYSA-N
XLogP2.04
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one?
The IUPAC name of 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one (CID 136822014) is 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one.
What is the SMILES notation for 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one?
The canonical SMILES for 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one is CC1(C)CN(c2cc(=O)[nH]c(C3CC3)n2)CC(C)(C)O1.
What is the InChIKey of 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one?
The InChIKey is QCAFNCITTCJWMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-14(2)8-18(9-15(3,4)20-14)11-7-12(19)17-13(16-11)10-5-6-10/h7,10H,5-6,8-9H2,1-4H3,(H,16,17,19).
What are the key properties of 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one?
2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one has a molecular weight of 277.37 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one is sourced from PubChem (CID 136822014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).