(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone

C16H13BrClN3O2 — CID 68798826

IUPAC(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone
SMILESCC1c2oc(Cl)cc2CCN1C(=O)c1cc2ccc(Br)cn2n1
InChIInChI=1S/C16H13BrClN3O2/c1-9-15-10(6-14(18)23-15)4-5-20(9)16(22)13-7-12-3-2-11(17)8-21(12)19-13/h2-3,6-9H,4-5H2,1H3
InChIKeyQWAXXNIGXAFEQD-UHFFFAOYSA-N
MW394.66 g/mol
LogP4.10
Rot. Bonds1

About (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone

(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone (PubChem CID 68798826) has the molecular formula C16H13BrClN3O2 and a molecular weight of 394.66 g/mol. Its IUPAC name is (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone.

Molecular Properties

Compound Name(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone
PubChem CID68798826
Molecular FormulaC16H13BrClN3O2
Molecular Weight394.66 g/mol
Exact Mass392.99
IUPAC Name(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone
SMILESCC1c2oc(Cl)cc2CCN1C(=O)c1cc2ccc(Br)cn2n1
InChIInChI=1S/C16H13BrClN3O2/c1-9-15-10(6-14(18)23-15)4-5-20(9)16(22)13-7-12-3-2-11(17)8-21(12)19-13/h2-3,6-9H,4-5H2,1H3
InChIKeyQWAXXNIGXAFEQD-UHFFFAOYSA-N
XLogP4.10
TPSA50.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.66
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone with MolForge

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Related Compounds

(6-bromo-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(6-bromopyrazolo[1,5-a]pyridin-2-yl)methanone
CID 68799758
(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(3-chloro-7-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)methanone
CID 68801842
(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(4-methyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridin-5-yl)methanone
CID 68801801
(6-bromopyrazolo[1,5-a]pyridin-2-yl)-[1-methyl-7-(5-methylfuran-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone
CID 68801591
(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(6,7-difluoro-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 68800281
(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(1,5-dimethyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(1,7-dimethyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(7-chloro-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(6-chloropyrazolo[1,5-a]pyridin-2-yl)methanone
CID 87675194
(6-bromo-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-(6-chloropyrazolo[1,5-a]pyridin-2-yl)methanone
CID 68800895
(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(6-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 68801662
(6-chloropyrazolo[1,5-a]pyridin-2-yl)-[6-(furan-2-yl)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]methanone
CID 68801737
(6-bromopyrazolo[1,5-a]pyridin-2-yl)-[3-(furan-3-yl)-8-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]methanone
CID 68801629
(6-bromo-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(6-bromopyrazolo[1,5-a]pyrimidin-2-yl)methanone
CID 24810730
(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,5,5-trimethyl-3,4-dihydro-1H-cyclopenta[c]pyridin-2-yl)methanone
CID 68801185

Frequently Asked Questions

What is the IUPAC name of (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone?
The IUPAC name of (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone (CID 68798826) is (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone.
What is the SMILES notation for (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone?
The canonical SMILES for (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone is CC1c2oc(Cl)cc2CCN1C(=O)c1cc2ccc(Br)cn2n1.
What is the InChIKey of (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone?
The InChIKey is QWAXXNIGXAFEQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13BrClN3O2/c1-9-15-10(6-14(18)23-15)4-5-20(9)16(22)13-7-12-3-2-11(17)8-21(12)19-13/h2-3,6-9H,4-5H2,1H3.
What are the key properties of (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone?
(6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone has a molecular weight of 394.66 g/mol, XLogP of 4.10, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromopyrazolo[1,5-a]pyridin-2-yl)-(2-chloro-7-methyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)methanone is sourced from PubChem (CID 68798826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).