2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one

C10H15N3O — CID 83878468

IUPAC2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one
SMILESCNCCc1cnc(C2CC2)[nH]c1=O
InChIInChI=1S/C10H15N3O/c1-11-5-4-8-6-12-9(7-2-3-7)13-10(8)14/h6-7,11H,2-5H2,1H3,(H,12,13,14)
InChIKeyPAHYZXXKTNULJN-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.41
Rot. Bonds4

About 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one

2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one (PubChem CID 83878468) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one
PubChem CID83878468
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one
SMILESCNCCc1cnc(C2CC2)[nH]c1=O
InChIInChI=1S/C10H15N3O/c1-11-5-4-8-6-12-9(7-2-3-7)13-10(8)14/h6-7,11H,2-5H2,1H3,(H,12,13,14)
InChIKeyPAHYZXXKTNULJN-UHFFFAOYSA-N
XLogP0.41
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one?
The IUPAC name of 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one (CID 83878468) is 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one.
What is the SMILES notation for 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one?
The canonical SMILES for 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one is CNCCc1cnc(C2CC2)[nH]c1=O.
What is the InChIKey of 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one?
The InChIKey is PAHYZXXKTNULJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-11-5-4-8-6-12-9(7-2-3-7)13-10(8)14/h6-7,11H,2-5H2,1H3,(H,12,13,14).
What are the key properties of 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one?
2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one has a molecular weight of 193.25 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-[2-(methylamino)ethyl]-1H-pyrimidin-6-one is sourced from PubChem (CID 83878468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).