2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol

C15H20F2N4O2 — CID 78318301

IUPAC2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol
SMILESCC(C)n1nc(-c2cnc(N)c(OC(F)F)c2)cc1C(C)(C)O
InChIInChI=1S/C15H20F2N4O2/c1-8(2)21-12(15(3,4)22)6-10(20-21)9-5-11(23-14(16)17)13(18)19-7-9/h5-8,14,22H,1-4H3,(H2,18,19)
InChIKeyPLOUFQTYXCNXCR-UHFFFAOYSA-N
MW326.35 g/mol
LogP2.94
Rot. Bonds5

About 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol

2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol (PubChem CID 78318301) has the molecular formula C15H20F2N4O2 and a molecular weight of 326.35 g/mol. Its IUPAC name is 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol.

Molecular Properties

Compound Name2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol
PubChem CID78318301
Molecular FormulaC15H20F2N4O2
Molecular Weight326.35 g/mol
Exact Mass326.16
IUPAC Name2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol
SMILESCC(C)n1nc(-c2cnc(N)c(OC(F)F)c2)cc1C(C)(C)O
InChIInChI=1S/C15H20F2N4O2/c1-8(2)21-12(15(3,4)22)6-10(20-21)9-5-11(23-14(16)17)13(18)19-7-9/h5-8,14,22H,1-4H3,(H2,18,19)
InChIKeyPLOUFQTYXCNXCR-UHFFFAOYSA-N
XLogP2.94
TPSA86.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol with MolForge

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Related Compounds

14-Fluoro-3-methyl-10,18-dioxa-3,4,21-triazatetracyclo[17.3.1.02,6.011,16]tricosa-1(23),2(6),4,11(16),12,14,19,21-octaen-20-amine
CID 71732092
(2S)-1-[[4-[3-(6-amino-5-methoxy-3-pyridinyl)-1-propan-2-ylpyrazol-4-yl]pyrimidin-2-yl]amino]propan-2-ol
CID 57856282
15-Fluoro-3-methyl-11,19-dioxa-3,4,22-triazatetracyclo[18.3.1.02,6.012,17]tetracosa-1(24),2(6),4,12(17),13,15,20,22-octaen-21-amine
CID 71732097
1-[3-(2-Ethylpyrazol-3-yl)oxy-5-[(3-hydroxy-3-methylcyclobutyl)methyl]-2-pyridinyl]-3-methylurea
CID 77460994
3-Methoxy-5-[5-[1-(oxetan-3-yl)piperidin-4-yl]-1-propan-2-ylpyrazol-3-yl]pyridin-2-amine
CID 78318141
3-methoxy-5-[5-[(1S,5R)-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-1-propan-2-ylpyrazol-3-yl]pyridin-2-amine
CID 90292708
3-(difluoromethoxy)-5-[5-[(1R,5S)-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-1-propan-2-ylpyrazol-3-yl]pyridin-2-amine
CID 90292721
Dlk-IN-1
CID 90292823
2-[4-[[4-[1-Cyclopropyl-3-(4,4-difluorocyclohexyl)pyrazol-4-yl]oxypyridin-2-yl]amino]pyridin-2-yl]propan-2-ol
CID 150486404
2-[4-[[4-(1-Cyclopropyl-3-phenylpyrazol-4-yl)oxy-2-pyridinyl]amino]-2-pyridinyl]propan-2-ol
CID 151595124
2-[4-[[4-[1-Cyclopropyl-3-(3,3-difluorocyclobutyl)pyrazol-4-yl]oxy-2-pyridinyl]amino]-2-pyridinyl]-1,1,1-trifluoropropan-2-ol
CID 153533399
Tgf|ari-IN-4
CID 162618103

Frequently Asked Questions

What is the IUPAC name of 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol?
The IUPAC name of 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol (CID 78318301) is 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol.
What is the SMILES notation for 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol?
The canonical SMILES for 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol is CC(C)n1nc(-c2cnc(N)c(OC(F)F)c2)cc1C(C)(C)O.
What is the InChIKey of 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol?
The InChIKey is PLOUFQTYXCNXCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N4O2/c1-8(2)21-12(15(3,4)22)6-10(20-21)9-5-11(23-14(16)17)13(18)19-7-9/h5-8,14,22H,1-4H3,(H2,18,19).
What are the key properties of 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol?
2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol has a molecular weight of 326.35 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-1-propan-2-ylpyrazol-5-yl]propan-2-ol is sourced from PubChem (CID 78318301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).