4-methoxy-2-(methylamino)pyrimidine-5-carboxamide

C7H10N4O2 — CID 19883403

IUPAC4-methoxy-2-(methylamino)pyrimidine-5-carboxamide
SMILESCNc1ncc(C(N)=O)c(OC)n1
InChIInChI=1S/C7H10N4O2/c1-9-7-10-3-4(5(8)12)6(11-7)13-2/h3H,1-2H3,(H2,8,12)(H,9,10,11)
InChIKeyFKTWXYIRQDANIL-UHFFFAOYSA-N
MW182.18 g/mol
LogP-0.37
Rot. Bonds3

About 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide

4-methoxy-2-(methylamino)pyrimidine-5-carboxamide (PubChem CID 19883403) has the molecular formula C7H10N4O2 and a molecular weight of 182.18 g/mol. Its IUPAC name is 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-methoxy-2-(methylamino)pyrimidine-5-carboxamide
PubChem CID19883403
Molecular FormulaC7H10N4O2
Molecular Weight182.18 g/mol
Exact Mass182.08
IUPAC Name4-methoxy-2-(methylamino)pyrimidine-5-carboxamide
SMILESCNc1ncc(C(N)=O)c(OC)n1
InChIInChI=1S/C7H10N4O2/c1-9-7-10-3-4(5(8)12)6(11-7)13-2/h3H,1-2H3,(H2,8,12)(H,9,10,11)
InChIKeyFKTWXYIRQDANIL-UHFFFAOYSA-N
XLogP-0.37
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide?
The IUPAC name of 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide (CID 19883403) is 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide.
What is the SMILES notation for 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide?
The canonical SMILES for 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide is CNc1ncc(C(N)=O)c(OC)n1.
What is the InChIKey of 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide?
The InChIKey is FKTWXYIRQDANIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O2/c1-9-7-10-3-4(5(8)12)6(11-7)13-2/h3H,1-2H3,(H2,8,12)(H,9,10,11).
What are the key properties of 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide?
4-methoxy-2-(methylamino)pyrimidine-5-carboxamide has a molecular weight of 182.18 g/mol, XLogP of -0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(methylamino)pyrimidine-5-carboxamide is sourced from PubChem (CID 19883403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).