2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide

C15H19N7O — CID 156522188

IUPAC2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide
SMILESCc1n[nH]c(C)c1Nc1nccc2c1ncn2CC(=O)N(C)C
InChIInChI=1S/C15H19N7O/c1-9-13(10(2)20-19-9)18-15-14-11(5-6-16-15)22(8-17-14)7-12(23)21(3)4/h5-6,8H,7H2,1-4H3,(H,16,18)(H,19,20)
InChIKeyPQBSHHAGNHAGBZ-UHFFFAOYSA-N
MW313.37 g/mol
LogP1.60
Rot. Bonds4

About 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide

2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide (PubChem CID 156522188) has the molecular formula C15H19N7O and a molecular weight of 313.37 g/mol. Its IUPAC name is 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide
PubChem CID156522188
Molecular FormulaC15H19N7O
Molecular Weight313.37 g/mol
Exact Mass313.17
IUPAC Name2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide
SMILESCc1n[nH]c(C)c1Nc1nccc2c1ncn2CC(=O)N(C)C
InChIInChI=1S/C15H19N7O/c1-9-13(10(2)20-19-9)18-15-14-11(5-6-16-15)22(8-17-14)7-12(23)21(3)4/h5-6,8H,7H2,1-4H3,(H,16,18)(H,19,20)
InChIKeyPQBSHHAGNHAGBZ-UHFFFAOYSA-N
XLogP1.60
TPSA91.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide?
The IUPAC name of 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide (CID 156522188) is 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide is Cc1n[nH]c(C)c1Nc1nccc2c1ncn2CC(=O)N(C)C.
What is the InChIKey of 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide?
The InChIKey is PQBSHHAGNHAGBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N7O/c1-9-13(10(2)20-19-9)18-15-14-11(5-6-16-15)22(8-17-14)7-12(23)21(3)4/h5-6,8H,7H2,1-4H3,(H,16,18)(H,19,20).
What are the key properties of 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide?
2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide has a molecular weight of 313.37 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]imidazo[4,5-c]pyridin-1-yl]-N,N-dimethylacetamide is sourced from PubChem (CID 156522188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).