2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide

C13H17N5OS — CID 118789124

IUPAC2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NCC(C)c2nc(C)cs2)nc(N)n1
InChIInChI=1S/C13H17N5OS/c1-7(12-16-9(3)6-20-12)5-15-11(19)10-4-8(2)17-13(14)18-10/h4,6-7H,5H2,1-3H3,(H,15,19)(H2,14,17,18)
InChIKeyOQLHGSUVEFPGHS-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.67
Rot. Bonds4

About 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide

2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide (PubChem CID 118789124) has the molecular formula C13H17N5OS and a molecular weight of 291.38 g/mol. Its IUPAC name is 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide
PubChem CID118789124
Molecular FormulaC13H17N5OS
Molecular Weight291.38 g/mol
Exact Mass291.12
IUPAC Name2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NCC(C)c2nc(C)cs2)nc(N)n1
InChIInChI=1S/C13H17N5OS/c1-7(12-16-9(3)6-20-12)5-15-11(19)10-4-8(2)17-13(14)18-10/h4,6-7H,5H2,1-3H3,(H,15,19)(H2,14,17,18)
InChIKeyOQLHGSUVEFPGHS-UHFFFAOYSA-N
XLogP1.67
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-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 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide (CID 118789124) is 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide is Cc1cc(C(=O)NCC(C)c2nc(C)cs2)nc(N)n1.
What is the InChIKey of 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide?
The InChIKey is OQLHGSUVEFPGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5OS/c1-7(12-16-9(3)6-20-12)5-15-11(19)10-4-8(2)17-13(14)18-10/h4,6-7H,5H2,1-3H3,(H,15,19)(H2,14,17,18).
What are the key properties of 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide?
2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propyl]pyrimidine-4-carboxamide is sourced from PubChem (CID 118789124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).