4-amino-2-propan-2-yloxypyrimidine-5-carboxamide

C8H12N4O2 — CID 70683674

IUPAC4-amino-2-propan-2-yloxypyrimidine-5-carboxamide
SMILESCC(C)Oc1ncc(C(N)=O)c(N)n1
InChIInChI=1S/C8H12N4O2/c1-4(2)14-8-11-3-5(7(10)13)6(9)12-8/h3-4H,1-2H3,(H2,10,13)(H2,9,11,12)
InChIKeyNIDLQHJJQFZLHE-UHFFFAOYSA-N
MW196.21 g/mol
LogP-0.06
Rot. Bonds3

About 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide

4-amino-2-propan-2-yloxypyrimidine-5-carboxamide (PubChem CID 70683674) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-propan-2-yloxypyrimidine-5-carboxamide
PubChem CID70683674
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name4-amino-2-propan-2-yloxypyrimidine-5-carboxamide
SMILESCC(C)Oc1ncc(C(N)=O)c(N)n1
InChIInChI=1S/C8H12N4O2/c1-4(2)14-8-11-3-5(7(10)13)6(9)12-8/h3-4H,1-2H3,(H2,10,13)(H2,9,11,12)
InChIKeyNIDLQHJJQFZLHE-UHFFFAOYSA-N
XLogP-0.06
TPSA104.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide?
The IUPAC name of 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide (CID 70683674) is 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide.
What is the SMILES notation for 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide?
The canonical SMILES for 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide is CC(C)Oc1ncc(C(N)=O)c(N)n1.
What is the InChIKey of 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide?
The InChIKey is NIDLQHJJQFZLHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c1-4(2)14-8-11-3-5(7(10)13)6(9)12-8/h3-4H,1-2H3,(H2,10,13)(H2,9,11,12).
What are the key properties of 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide?
4-amino-2-propan-2-yloxypyrimidine-5-carboxamide has a molecular weight of 196.21 g/mol, XLogP of -0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-propan-2-yloxypyrimidine-5-carboxamide is sourced from PubChem (CID 70683674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).