N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide

C19H19N7O2 — CID 70234985

About N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide

N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide (PubChem CID 70234985) has the molecular formula C19H19N7O2 and a molecular weight of 377.41 g/mol. Its IUPAC name is N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide
• PubChem CID: 70234985
• Molecular Formula: C19H19N7O2
• Molecular Weight: 377.41 g/mol
• Exact Mass: 377.16
• IUPAC Name: N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide
• SMILES: CN1C(=O)CC(C)(c2cc(NC(=O)c3cc4cccn4cn3)ccn2)N=C1N
• InChI: InChI=1S/C19H19N7O2/c1-19(10-16(27)25(2)18(20)24-19)15-8-12(5-6-21-15)23-17(28)14-9-13-4-3-7-26(13)11-22-14/h3-9,11H,10H2,1-2H3,(H2,20,24)(H,21,23,28)
• InChIKey: FPXGCKBAGQZENT-UHFFFAOYSA-N
• XLogP: 1.37
• TPSA: 117.98 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	377.41
LogP ≤ 5	1.37
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide?

The IUPAC name of N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide (CID 70234985) is N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide.

What is the SMILES notation for N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide?

The canonical SMILES for N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide is CN1C(=O)CC(C)(c2cc(NC(=O)c3cc4cccn4cn3)ccn2)N=C1N.

What is the InChIKey of N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide?

The InChIKey is FPXGCKBAGQZENT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N7O2/c1-19(10-16(27)25(2)18(20)24-19)15-8-12(5-6-21-15)23-17(28)14-9-13-4-3-7-26(13)11-22-14/h3-9,11H,10H2,1-2H3,(H2,20,24)(H,21,23,28).

What are the key properties of N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide?

N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide has a molecular weight of 377.41 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide is sourced from PubChem (CID 70234985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).