4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide

C7H11N5O — CID 116648121

IUPAC4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide
SMILESCNc1nc(C)c(C(N)=O)c(N)n1
InChIInChI=1S/C7H11N5O/c1-3-4(6(9)13)5(8)12-7(10-2)11-3/h1-2H3,(H2,9,13)(H3,8,10,11,12)
InChIKeyBLSGGACOQOMEJS-UHFFFAOYSA-N
MW181.20 g/mol
LogP-0.49
Rot. Bonds2

About 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide

4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide (PubChem CID 116648121) has the molecular formula C7H11N5O and a molecular weight of 181.20 g/mol. Its IUPAC name is 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide
PubChem CID116648121
Molecular FormulaC7H11N5O
Molecular Weight181.20 g/mol
Exact Mass181.10
IUPAC Name4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide
SMILESCNc1nc(C)c(C(N)=O)c(N)n1
InChIInChI=1S/C7H11N5O/c1-3-4(6(9)13)5(8)12-7(10-2)11-3/h1-2H3,(H2,9,13)(H3,8,10,11,12)
InChIKeyBLSGGACOQOMEJS-UHFFFAOYSA-N
XLogP-0.49
TPSA106.92 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide?
The IUPAC name of 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide (CID 116648121) is 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide.
What is the SMILES notation for 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide?
The canonical SMILES for 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide is CNc1nc(C)c(C(N)=O)c(N)n1.
What is the InChIKey of 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide?
The InChIKey is BLSGGACOQOMEJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5O/c1-3-4(6(9)13)5(8)12-7(10-2)11-3/h1-2H3,(H2,9,13)(H3,8,10,11,12).
What are the key properties of 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide?
4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide has a molecular weight of 181.20 g/mol, XLogP of -0.49, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-methyl-2-(methylamino)pyrimidine-5-carboxamide is sourced from PubChem (CID 116648121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).