5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine

C22H26FN7 — CID 142460309

IUPAC5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCc1[nH]ncc1CCNc1cc(-c2cncc(F)c2)nc2c(C(C)C)cnn12
InChIInChI=1S/C22H26FN7/c1-4-5-19-15(11-26-29-19)6-7-25-21-9-20(16-8-17(23)12-24-10-16)28-22-18(14(2)3)13-27-30(21)22/h8-14,25H,4-7H2,1-3H3,(H,26,29)
InChIKeyRRZITSBZXFVAPU-UHFFFAOYSA-N
MW407.50 g/mol
LogP4.38
Rot. Bonds8

About 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine

5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 142460309) has the molecular formula C22H26FN7 and a molecular weight of 407.50 g/mol. Its IUPAC name is 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID142460309
Molecular FormulaC22H26FN7
Molecular Weight407.50 g/mol
Exact Mass407.22
IUPAC Name5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCc1[nH]ncc1CCNc1cc(-c2cncc(F)c2)nc2c(C(C)C)cnn12
InChIInChI=1S/C22H26FN7/c1-4-5-19-15(11-26-29-19)6-7-25-21-9-20(16-8-17(23)12-24-10-16)28-22-18(14(2)3)13-27-30(21)22/h8-14,25H,4-7H2,1-3H3,(H,26,29)
InChIKeyRRZITSBZXFVAPU-UHFFFAOYSA-N
XLogP4.38
TPSA83.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.50
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine with MolForge

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Related Compounds

N-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 167320617
5-(5-fluoro-3-pyridinyl)-N-[(2R)-1-(1H-indol-3-yl)propan-2-yl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 140944726
3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indole-5,7-diol
CID 140944585
5-(5-fluoro-3-pyridinyl)-3-methyl-N-[2-(1H-pyrrolo[3,2-b]pyridin-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 140944634
5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[(5S)-4,5,6,7-tetrahydro-3H-benzimidazol-5-yl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 135376593
N-[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]spiro[1,4,5,7-tetrahydrobenzimidazole-6,2'-cyclopropane]-1'-amine
CID 163575421
(1'S)-N-[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]spiro[1,4,5,7-tetrahydrobenzimidazole-6,2'-cyclopropane]-1'-amine
CID 142460402
5-(1,3-benzodioxol-5-yl)-N-[2-(1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 140944753
5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)propyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 135376544
(3R)-8-fluoro-N-[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]-2,3,4,9-tetrahydro-1H-carbazol-3-amine
CID 146406312
[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]-morpholin-4-ylmethanone
CID 135376370
tert-butyl 4-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidine-3-carbonyl]piperazine-1-carboxylate
CID 135376549

Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 142460309) is 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine is CCCc1[nH]ncc1CCNc1cc(-c2cncc(F)c2)nc2c(C(C)C)cnn12.
What is the InChIKey of 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is RRZITSBZXFVAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26FN7/c1-4-5-19-15(11-26-29-19)6-7-25-21-9-20(16-8-17(23)12-24-10-16)28-22-18(14(2)3)13-27-30(21)22/h8-14,25H,4-7H2,1-3H3,(H,26,29).
What are the key properties of 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 407.50 g/mol, XLogP of 4.38, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-fluoro-3-pyridinyl)-3-propan-2-yl-N-[2-(5-propyl-1H-pyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 142460309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).