6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione

C9H13N3O2 — CID 118711589

IUPAC6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione
SMILESCCn1c(=O)cc(N)n(C2CC2)c1=O
InChIInChI=1S/C9H13N3O2/c1-2-11-8(13)5-7(10)12(9(11)14)6-3-4-6/h5-6H,2-4,10H2,1H3
InChIKeyQOZGRUYCSXVZQW-UHFFFAOYSA-N
MW195.22 g/mol
LogP-0.05
Rot. Bonds2

About 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione

6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione (PubChem CID 118711589) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione
PubChem CID118711589
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione
SMILESCCn1c(=O)cc(N)n(C2CC2)c1=O
InChIInChI=1S/C9H13N3O2/c1-2-11-8(13)5-7(10)12(9(11)14)6-3-4-6/h5-6H,2-4,10H2,1H3
InChIKeyQOZGRUYCSXVZQW-UHFFFAOYSA-N
XLogP-0.05
TPSA70.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione (CID 118711589) is 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione is CCn1c(=O)cc(N)n(C2CC2)c1=O.
What is the InChIKey of 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione?
The InChIKey is QOZGRUYCSXVZQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-2-11-8(13)5-7(10)12(9(11)14)6-3-4-6/h5-6H,2-4,10H2,1H3.
What are the key properties of 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione?
6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione has a molecular weight of 195.22 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-cyclopropyl-3-ethylpyrimidine-2,4-dione is sourced from PubChem (CID 118711589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).