6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine

C20H21N7O — CID 134284282

IUPAC6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1-c1cn[nH]c1
InChIInChI=1S/C20H21N7O/c1-28-18-7-20-22-11-17(27(20)12-15(18)13-8-23-24-9-13)16-3-2-4-19(26-16)25-14-5-6-21-10-14/h2-4,7-9,11-12,14,21H,5-6,10H2,1H3,(H,23,24)(H,25,26)
InChIKeyZMZGUJSLGMATGF-UHFFFAOYSA-N
MW375.44 g/mol
LogP2.57
Rot. Bonds5

About 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine

6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine (PubChem CID 134284282) has the molecular formula C20H21N7O and a molecular weight of 375.44 g/mol. Its IUPAC name is 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine.

Molecular Properties

Compound Name6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine
PubChem CID134284282
Molecular FormulaC20H21N7O
Molecular Weight375.44 g/mol
Exact Mass375.18
IUPAC Name6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1-c1cn[nH]c1
InChIInChI=1S/C20H21N7O/c1-28-18-7-20-22-11-17(27(20)12-15(18)13-8-23-24-9-13)16-3-2-4-19(26-16)25-14-5-6-21-10-14/h2-4,7-9,11-12,14,21H,5-6,10H2,1H3,(H,23,24)(H,25,26)
InChIKeyZMZGUJSLGMATGF-UHFFFAOYSA-N
XLogP2.57
TPSA92.16 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.44
LogP ≤ 52.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine?
The IUPAC name of 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine (CID 134284282) is 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine.
What is the SMILES notation for 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine?
The canonical SMILES for 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine is COc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1-c1cn[nH]c1.
What is the InChIKey of 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine?
The InChIKey is ZMZGUJSLGMATGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N7O/c1-28-18-7-20-22-11-17(27(20)12-15(18)13-8-23-24-9-13)16-3-2-4-19(26-16)25-14-5-6-21-10-14/h2-4,7-9,11-12,14,21H,5-6,10H2,1H3,(H,23,24)(H,25,26).
What are the key properties of 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine?
6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine has a molecular weight of 375.44 g/mol, XLogP of 2.57, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine is sourced from PubChem (CID 134284282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).