2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one

C14H24N4O — CID 136870179

IUPAC2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one
SMILESCCCN(CC)CCNc1cc(=O)[nH]c(C2CC2)n1
InChIInChI=1S/C14H24N4O/c1-3-8-18(4-2)9-7-15-12-10-13(19)17-14(16-12)11-5-6-11/h10-11H,3-9H2,1-2H3,(H2,15,16,17,19)
InChIKeyJANDCJHIOZORFK-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.79
Rot. Bonds8

About 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one

2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one (PubChem CID 136870179) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one
PubChem CID136870179
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one
SMILESCCCN(CC)CCNc1cc(=O)[nH]c(C2CC2)n1
InChIInChI=1S/C14H24N4O/c1-3-8-18(4-2)9-7-15-12-10-13(19)17-14(16-12)11-5-6-11/h10-11H,3-9H2,1-2H3,(H2,15,16,17,19)
InChIKeyJANDCJHIOZORFK-UHFFFAOYSA-N
XLogP1.79
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one?
The IUPAC name of 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one (CID 136870179) is 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one.
What is the SMILES notation for 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one?
The canonical SMILES for 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one is CCCN(CC)CCNc1cc(=O)[nH]c(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one?
The InChIKey is JANDCJHIOZORFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-8-18(4-2)9-7-15-12-10-13(19)17-14(16-12)11-5-6-11/h10-11H,3-9H2,1-2H3,(H2,15,16,17,19).
What are the key properties of 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one?
2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one has a molecular weight of 264.37 g/mol, XLogP of 1.79, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-[2-[ethyl(propyl)amino]ethylamino]-1H-pyrimidin-6-one is sourced from PubChem (CID 136870179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).