4-amino-N-ethylpyrimidine-2-carboxamide

C7H10N4O — CID 117213053

IUPAC4-amino-N-ethylpyrimidine-2-carboxamide
SMILESCCNC(=O)c1nccc(N)n1
InChIInChI=1S/C7H10N4O/c1-2-9-7(12)6-10-4-3-5(8)11-6/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11)
InChIKeyYRYFXKLPZDXEHV-UHFFFAOYSA-N
MW166.18 g/mol
LogP-0.19
Rot. Bonds2

About 4-amino-N-ethylpyrimidine-2-carboxamide

4-amino-N-ethylpyrimidine-2-carboxamide (PubChem CID 117213053) has the molecular formula C7H10N4O and a molecular weight of 166.18 g/mol. Its IUPAC name is 4-amino-N-ethylpyrimidine-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethylpyrimidine-2-carboxamide
PubChem CID117213053
Molecular FormulaC7H10N4O
Molecular Weight166.18 g/mol
Exact Mass166.09
IUPAC Name4-amino-N-ethylpyrimidine-2-carboxamide
SMILESCCNC(=O)c1nccc(N)n1
InChIInChI=1S/C7H10N4O/c1-2-9-7(12)6-10-4-3-5(8)11-6/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11)
InChIKeyYRYFXKLPZDXEHV-UHFFFAOYSA-N
XLogP-0.19
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethylpyrimidine-2-carboxamide?
The IUPAC name of 4-amino-N-ethylpyrimidine-2-carboxamide (CID 117213053) is 4-amino-N-ethylpyrimidine-2-carboxamide.
What is the SMILES notation for 4-amino-N-ethylpyrimidine-2-carboxamide?
The canonical SMILES for 4-amino-N-ethylpyrimidine-2-carboxamide is CCNC(=O)c1nccc(N)n1.
What is the InChIKey of 4-amino-N-ethylpyrimidine-2-carboxamide?
The InChIKey is YRYFXKLPZDXEHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O/c1-2-9-7(12)6-10-4-3-5(8)11-6/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11).
What are the key properties of 4-amino-N-ethylpyrimidine-2-carboxamide?
4-amino-N-ethylpyrimidine-2-carboxamide has a molecular weight of 166.18 g/mol, XLogP of -0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethylpyrimidine-2-carboxamide is sourced from PubChem (CID 117213053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).