2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide

C24H22N8O2 — CID 90683646

IUPAC2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide
SMILESCc1ccn2cc(CC(=O)Nc3cncc(C(=O)c4cn(C(C)C)c5ncncc45)c3)nc2n1
InChIInChI=1S/C24H22N8O2/c1-14(2)32-12-20(19-10-26-13-27-23(19)32)22(34)16-6-17(9-25-8-16)29-21(33)7-18-11-31-5-4-15(3)28-24(31)30-18/h4-6,8-14H,7H2,1-3H3,(H,29,33)
InChIKeyKPOHUAYAPHRLOL-UHFFFAOYSA-N
MW454.49 g/mol
LogP3.17
Rot. Bonds6

About 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide

2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide (PubChem CID 90683646) has the molecular formula C24H22N8O2 and a molecular weight of 454.49 g/mol. Its IUPAC name is 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide
PubChem CID90683646
Molecular FormulaC24H22N8O2
Molecular Weight454.49 g/mol
Exact Mass454.19
IUPAC Name2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide
SMILESCc1ccn2cc(CC(=O)Nc3cncc(C(=O)c4cn(C(C)C)c5ncncc45)c3)nc2n1
InChIInChI=1S/C24H22N8O2/c1-14(2)32-12-20(19-10-26-13-27-23(19)32)22(34)16-6-17(9-25-8-16)29-21(33)7-18-11-31-5-4-15(3)28-24(31)30-18/h4-6,8-14H,7H2,1-3H3,(H,29,33)
InChIKeyKPOHUAYAPHRLOL-UHFFFAOYSA-N
XLogP3.17
TPSA119.96 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.49
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide 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-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide?
The IUPAC name of 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide (CID 90683646) is 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide is Cc1ccn2cc(CC(=O)Nc3cncc(C(=O)c4cn(C(C)C)c5ncncc45)c3)nc2n1.
What is the InChIKey of 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide?
The InChIKey is KPOHUAYAPHRLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N8O2/c1-14(2)32-12-20(19-10-26-13-27-23(19)32)22(34)16-6-17(9-25-8-16)29-21(33)7-18-11-31-5-4-15(3)28-24(31)30-18/h4-6,8-14H,7H2,1-3H3,(H,29,33).
What are the key properties of 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide?
2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide has a molecular weight of 454.49 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methylimidazo[1,2-a]pyrimidin-2-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide is sourced from PubChem (CID 90683646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).