2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide

C8H12N4O2 — CID 130226789

IUPAC2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide
SMILESCCNC(=O)c1nc(N)ncc1OC
InChIInChI=1S/C8H12N4O2/c1-3-10-7(13)6-5(14-2)4-11-8(9)12-6/h4H,3H2,1-2H3,(H,10,13)(H2,9,11,12)
InChIKeyXMNUNXFRDMZMQD-UHFFFAOYSA-N
MW196.21 g/mol
LogP-0.18
Rot. Bonds3

About 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide

2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide (PubChem CID 130226789) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide
PubChem CID130226789
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide
SMILESCCNC(=O)c1nc(N)ncc1OC
InChIInChI=1S/C8H12N4O2/c1-3-10-7(13)6-5(14-2)4-11-8(9)12-6/h4H,3H2,1-2H3,(H,10,13)(H2,9,11,12)
InChIKeyXMNUNXFRDMZMQD-UHFFFAOYSA-N
XLogP-0.18
TPSA90.13 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 ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide?
The IUPAC name of 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide (CID 130226789) is 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide is CCNC(=O)c1nc(N)ncc1OC.
What is the InChIKey of 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide?
The InChIKey is XMNUNXFRDMZMQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c1-3-10-7(13)6-5(14-2)4-11-8(9)12-6/h4H,3H2,1-2H3,(H,10,13)(H2,9,11,12).
What are the key properties of 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide?
2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide has a molecular weight of 196.21 g/mol, XLogP of -0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-5-methoxypyrimidine-4-carboxamide is sourced from PubChem (CID 130226789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).