4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one

C10H15N3O2 — CID 102741500

IUPAC4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one
SMILESCN(CCOc1cc(=O)[nH]cn1)C1CC1
InChIInChI=1S/C10H15N3O2/c1-13(8-2-3-8)4-5-15-10-6-9(14)11-7-12-10/h6-8H,2-5H2,1H3,(H,11,12,14)
InChIKeyDFYJLKWQRMQVFK-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.24
Rot. Bonds5

About 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one

4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one (PubChem CID 102741500) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one
PubChem CID102741500
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one
SMILESCN(CCOc1cc(=O)[nH]cn1)C1CC1
InChIInChI=1S/C10H15N3O2/c1-13(8-2-3-8)4-5-15-10-6-9(14)11-7-12-10/h6-8H,2-5H2,1H3,(H,11,12,14)
InChIKeyDFYJLKWQRMQVFK-UHFFFAOYSA-N
XLogP0.24
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one
CID 102740468
5-bromo-4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one
CID 102740474
4-[2-[cyclopropyl(methyl)amino]ethoxy]-5-iodo-1H-pyrimidin-6-one
CID 102740477
5-amino-4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one
CID 102741495
4-[2-[cyclopropyl(methyl)amino]ethoxy]-2-methyl-1H-pyrimidin-6-one
CID 102741496
4-[2-[cyclopropyl(methyl)amino]ethoxy]-5-methoxy-1H-pyrimidin-6-one
CID 102741498
4-[2-[cyclopropyl(methyl)amino]ethoxy]-2-propan-2-yl-1H-pyrimidin-6-one
CID 102741502
4-[2-(dimethylamino)ethoxy]-1H-pyrimidin-6-one
CID 103241383
4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one
CID 103241419
4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one
CID 103241431
4-[3-(dimethylamino)propoxy]-1H-pyrimidin-6-one
CID 103241445
4-[2-(dimethylamino)-2-methylpropoxy]-1H-pyrimidin-6-one
CID 103241803

Frequently Asked Questions

What is the IUPAC name of 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one?
The IUPAC name of 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one (CID 102741500) is 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one?
The canonical SMILES for 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one is CN(CCOc1cc(=O)[nH]cn1)C1CC1.
What is the InChIKey of 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one?
The InChIKey is DFYJLKWQRMQVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-13(8-2-3-8)4-5-15-10-6-9(14)11-7-12-10/h6-8H,2-5H2,1H3,(H,11,12,14).
What are the key properties of 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one?
4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one has a molecular weight of 209.25 g/mol, XLogP of 0.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one is sourced from PubChem (CID 102741500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).