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

C24H21N7O2 — CID 90683610

IUPAC2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide
SMILESCC(C)n1cc(C(=O)c2cncc(NC(=O)Cc3ccn4ccnc4c3)c2)c2cncnc21
InChIInChI=1S/C24H21N7O2/c1-15(2)31-13-20(19-12-26-14-28-24(19)31)23(33)17-9-18(11-25-10-17)29-22(32)8-16-3-5-30-6-4-27-21(30)7-16/h3-7,9-15H,8H2,1-2H3,(H,29,32)
InChIKeyATCHMAIFFQQDIX-UHFFFAOYSA-N
MW439.48 g/mol
LogP3.47
Rot. Bonds6

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

2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide (PubChem CID 90683610) has the molecular formula C24H21N7O2 and a molecular weight of 439.48 g/mol. Its IUPAC name is 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide
PubChem CID90683610
Molecular FormulaC24H21N7O2
Molecular Weight439.48 g/mol
Exact Mass439.18
IUPAC Name2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide
SMILESCC(C)n1cc(C(=O)c2cncc(NC(=O)Cc3ccn4ccnc4c3)c2)c2cncnc21
InChIInChI=1S/C24H21N7O2/c1-15(2)31-13-20(19-12-26-14-28-24(19)31)23(33)17-9-18(11-25-10-17)29-22(32)8-16-3-5-30-6-4-27-21(30)7-16/h3-7,9-15H,8H2,1-2H3,(H,29,32)
InChIKeyATCHMAIFFQQDIX-UHFFFAOYSA-N
XLogP3.47
TPSA107.07 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.48
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide?
The IUPAC name of 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide (CID 90683610) is 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide is CC(C)n1cc(C(=O)c2cncc(NC(=O)Cc3ccn4ccnc4c3)c2)c2cncnc21.
What is the InChIKey of 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide?
The InChIKey is ATCHMAIFFQQDIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N7O2/c1-15(2)31-13-20(19-12-26-14-28-24(19)31)23(33)17-9-18(11-25-10-17)29-22(32)8-16-3-5-30-6-4-27-21(30)7-16/h3-7,9-15H,8H2,1-2H3,(H,29,32).
What are the key properties of 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide?
2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide has a molecular weight of 439.48 g/mol, XLogP of 3.47, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[1,2-a]pyridin-7-yl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide is sourced from PubChem (CID 90683610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).