2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol

C20H21N5O — CID 134202478

IUPAC2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol
SMILESCc1cccc(-c2nn(C)cc2-c2ccc3ncc(C(C)(C)O)n3c2)n1
InChIInChI=1S/C20H21N5O/c1-13-6-5-7-16(22-13)19-15(12-24(4)23-19)14-8-9-18-21-10-17(20(2,3)26)25(18)11-14/h5-12,26H,1-4H3
InChIKeyCKSKQNUOGZZIAJ-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.33
Rot. Bonds3

About 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol

2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol (PubChem CID 134202478) has the molecular formula C20H21N5O and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol.

Molecular Properties

Compound Name2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol
PubChem CID134202478
Molecular FormulaC20H21N5O
Molecular Weight347.42 g/mol
Exact Mass347.17
IUPAC Name2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol
SMILESCc1cccc(-c2nn(C)cc2-c2ccc3ncc(C(C)(C)O)n3c2)n1
InChIInChI=1S/C20H21N5O/c1-13-6-5-7-16(22-13)19-15(12-24(4)23-19)14-8-9-18-21-10-17(20(2,3)26)25(18)11-14/h5-12,26H,1-4H3
InChIKeyCKSKQNUOGZZIAJ-UHFFFAOYSA-N
XLogP3.33
TPSA68.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol?
The IUPAC name of 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol (CID 134202478) is 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol.
What is the SMILES notation for 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol?
The canonical SMILES for 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol is Cc1cccc(-c2nn(C)cc2-c2ccc3ncc(C(C)(C)O)n3c2)n1.
What is the InChIKey of 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol?
The InChIKey is CKSKQNUOGZZIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O/c1-13-6-5-7-16(22-13)19-15(12-24(4)23-19)14-8-9-18-21-10-17(20(2,3)26)25(18)11-14/h5-12,26H,1-4H3.
What are the key properties of 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol?
2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol has a molecular weight of 347.42 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol is sourced from PubChem (CID 134202478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).