4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one

C10H15N3O2 — CID 136827315

IUPAC4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one
SMILESO=c1cc(N(CCO)C2CCC2)nc[nH]1
InChIInChI=1S/C10H15N3O2/c14-5-4-13(8-2-1-3-8)9-6-10(15)12-7-11-9/h6-8,14H,1-5H2,(H,11,12,15)
InChIKeySEEOWWMYHZNLMQ-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.12
Rot. Bonds4

About 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one

4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one (PubChem CID 136827315) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one
PubChem CID136827315
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one
SMILESO=c1cc(N(CCO)C2CCC2)nc[nH]1
InChIInChI=1S/C10H15N3O2/c14-5-4-13(8-2-1-3-8)9-6-10(15)12-7-11-9/h6-8,14H,1-5H2,(H,11,12,15)
InChIKeySEEOWWMYHZNLMQ-UHFFFAOYSA-N
XLogP0.12
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-((2-Hydroxyethyl)amino)pyrimidin-4(1H)-one
CID 136271513
4-[2,2-difluoroethyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one
CID 136737797
4-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-1H-pyrimidin-6-one
CID 136737804
2-Amino-6-(1-hydroxypropan-2-ylamino)-3-methylpyrimidin-4-one
CID 130611731
4-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-1H-pyrimidin-6-one
CID 136781041
4-[cyclobutyl(3-hydroxypropyl)amino]-1H-pyrimidin-6-one
CID 136827306
5-bromo-4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one
CID 136827310
5-amino-4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one
CID 136827311
4-[cyclobutyl(2-hydroxyethyl)amino]-2-ethyl-1H-pyrimidin-6-one
CID 136827313
4-[cyclobutyl(2-hydroxyethyl)amino]-2-methyl-1H-pyrimidin-6-one
CID 136827314
4-[cyclobutyl(2-hydroxyethyl)amino]-5-iodo-1H-pyrimidin-6-one
CID 136827316
5-chloro-4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one
CID 136827317

Frequently Asked Questions

What is the IUPAC name of 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one?
The IUPAC name of 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one (CID 136827315) is 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one?
The canonical SMILES for 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one is O=c1cc(N(CCO)C2CCC2)nc[nH]1.
What is the InChIKey of 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one?
The InChIKey is SEEOWWMYHZNLMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c14-5-4-13(8-2-1-3-8)9-6-10(15)12-7-11-9/h6-8,14H,1-5H2,(H,11,12,15).
What are the key properties of 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one?
4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one has a molecular weight of 209.25 g/mol, XLogP of 0.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclobutyl(2-hydroxyethyl)amino]-1H-pyrimidin-6-one is sourced from PubChem (CID 136827315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).