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

C22H24N6O — CID 163877406

IUPACN-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(N(C)C4CCCC4)n3)n2cc1-c1cn[nH]c1
InChIInChI=1S/C22H24N6O/c1-27(16-6-3-4-7-16)21-9-5-8-18(26-21)19-13-23-22-10-20(29-2)17(14-28(19)22)15-11-24-25-12-15/h5,8-14,16H,3-4,6-7H2,1-2H3,(H,24,25)
InChIKeyJSOCNKKEKGJXFJ-UHFFFAOYSA-N
MW388.48 g/mol
LogP4.17
Rot. Bonds5

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

N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine (PubChem CID 163877406) has the molecular formula C22H24N6O and a molecular weight of 388.48 g/mol. Its IUPAC name is N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine
PubChem CID163877406
Molecular FormulaC22H24N6O
Molecular Weight388.48 g/mol
Exact Mass388.20
IUPAC NameN-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(N(C)C4CCCC4)n3)n2cc1-c1cn[nH]c1
InChIInChI=1S/C22H24N6O/c1-27(16-6-3-4-7-16)21-9-5-8-18(26-21)19-13-23-22-10-20(29-2)17(14-28(19)22)15-11-24-25-12-15/h5,8-14,16H,3-4,6-7H2,1-2H3,(H,24,25)
InChIKeyJSOCNKKEKGJXFJ-UHFFFAOYSA-N
XLogP4.17
TPSA71.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.48
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine?
The IUPAC name of N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine (CID 163877406) is N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine.
What is the SMILES notation for N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine?
The canonical SMILES for N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine is COc1cc2ncc(-c3cccc(N(C)C4CCCC4)n3)n2cc1-c1cn[nH]c1.
What is the InChIKey of N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine?
The InChIKey is JSOCNKKEKGJXFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6O/c1-27(16-6-3-4-7-16)21-9-5-8-18(26-21)19-13-23-22-10-20(29-2)17(14-28(19)22)15-11-24-25-12-15/h5,8-14,16H,3-4,6-7H2,1-2H3,(H,24,25).
What are the key properties of N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine?
N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine has a molecular weight of 388.48 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylpyridin-2-amine is sourced from PubChem (CID 163877406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).