N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide

C10H15N3O4 — CID 61235828

IUPACN,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
SMILESO=C(Cn1cccnc1=O)N(CCO)CCO
InChIInChI=1S/C10H15N3O4/c14-6-4-12(5-7-15)9(16)8-13-3-1-2-11-10(13)17/h1-3,14-15H,4-8H2
InChIKeyVQCPCUFGRGQXOE-UHFFFAOYSA-N
MW241.25 g/mol
LogP-1.94
Rot. Bonds6

About N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide

N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide (PubChem CID 61235828) has the molecular formula C10H15N3O4 and a molecular weight of 241.25 g/mol. Its IUPAC name is N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
PubChem CID61235828
Molecular FormulaC10H15N3O4
Molecular Weight241.25 g/mol
Exact Mass241.11
IUPAC NameN,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
SMILESO=C(Cn1cccnc1=O)N(CCO)CCO
InChIInChI=1S/C10H15N3O4/c14-6-4-12(5-7-15)9(16)8-13-3-1-2-11-10(13)17/h1-3,14-15H,4-8H2
InChIKeyVQCPCUFGRGQXOE-UHFFFAOYSA-N
XLogP-1.94
TPSA95.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 5-1.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide (CID 61235828) is N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide is O=C(Cn1cccnc1=O)N(CCO)CCO.
What is the InChIKey of N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The InChIKey is VQCPCUFGRGQXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O4/c14-6-4-12(5-7-15)9(16)8-13-3-1-2-11-10(13)17/h1-3,14-15H,4-8H2.
What are the key properties of N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide has a molecular weight of 241.25 g/mol, XLogP of -1.94, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 61235828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).