6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine

C20H23FN6O — CID 171505735

IUPAC6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine
SMILESCOc1cn2ncc(-c3nc(NC4CCCNC4)ccc3F)c2nc1C1CC1
InChIInChI=1S/C20H23FN6O/c1-28-16-11-27-20(26-18(16)12-4-5-12)14(10-23-27)19-15(21)6-7-17(25-19)24-13-3-2-8-22-9-13/h6-7,10-13,22H,2-5,8-9H2,1H3,(H,24,25)
InChIKeyWGLMYZMRGKIXCJ-UHFFFAOYSA-N
MW382.44 g/mol
LogP2.98
Rot. Bonds5

About 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine

6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine (PubChem CID 171505735) has the molecular formula C20H23FN6O and a molecular weight of 382.44 g/mol. Its IUPAC name is 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine.

Molecular Properties

Compound Name6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine
PubChem CID171505735
Molecular FormulaC20H23FN6O
Molecular Weight382.44 g/mol
Exact Mass382.19
IUPAC Name6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine
SMILESCOc1cn2ncc(-c3nc(NC4CCCNC4)ccc3F)c2nc1C1CC1
InChIInChI=1S/C20H23FN6O/c1-28-16-11-27-20(26-18(16)12-4-5-12)14(10-23-27)19-15(21)6-7-17(25-19)24-13-3-2-8-22-9-13/h6-7,10-13,22H,2-5,8-9H2,1H3,(H,24,25)
InChIKeyWGLMYZMRGKIXCJ-UHFFFAOYSA-N
XLogP2.98
TPSA76.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine with MolForge

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Related Compounds

6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-3,5-difluoro-N-(4-fluoropyrrolidin-3-yl)pyridin-2-amine
CID 171505712
4-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-(4-fluoropyrrolidin-3-yl)pyrimidin-2-amine
CID 171505733
6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-3-fluoro-N-(4-fluoropyrrolidin-3-yl)pyridin-2-amine
CID 171505626
6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-N-[(3S,4S)-4-fluoropyrrolidin-3-yl]pyridin-2-amine
CID 171505629
2-amino-6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoropyridine-3-carbonitrile
CID 171505600
2-chloro-6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoropyridine-3-carbonitrile
CID 171505548
5-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-[(3R)-piperidin-3-yl]pyridin-2-amine
CID 177159396
2-[3-[5-fluoro-2-[[(3S,4S)-4-fluoropiperidin-3-yl]amino]pyrimidin-4-yl]-6-methoxypyrazolo[1,5-a]pyrimidin-5-yl]propan-2-ol
CID 171505727
2-[3-[3,5-difluoro-6-[(4-fluoropiperidin-3-yl)amino]-2-pyridinyl]-6-methoxypyrazolo[1,5-a]pyrimidin-5-yl]propan-2-ol
CID 171505554
N-[(1Z)-1-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)buta-1,3-dienyl]-N'-pyrrolidin-3-ylcarbamimidoyl fluoride
CID 171505536
2-[3-[3-fluoro-6-[[(3R)-piperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyrazin-6-yl]propan-2-ol
CID 170646386
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-5-fluoro-N-[(3S,4S)-4-fluoropyrrolidin-3-yl]pyridin-2-amine
CID 170630990

Frequently Asked Questions

What is the IUPAC name of 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine?
The IUPAC name of 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine (CID 171505735) is 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine.
What is the SMILES notation for 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine?
The canonical SMILES for 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine is COc1cn2ncc(-c3nc(NC4CCCNC4)ccc3F)c2nc1C1CC1.
What is the InChIKey of 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine?
The InChIKey is WGLMYZMRGKIXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN6O/c1-28-16-11-27-20(26-18(16)12-4-5-12)14(10-23-27)19-15(21)6-7-17(25-19)24-13-3-2-8-22-9-13/h6-7,10-13,22H,2-5,8-9H2,1H3,(H,24,25).
What are the key properties of 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine?
6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine has a molecular weight of 382.44 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-cyclopropyl-6-methoxypyrazolo[1,5-a]pyrimidin-3-yl)-5-fluoro-N-piperidin-3-ylpyridin-2-amine is sourced from PubChem (CID 171505735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).