5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

C19H16FN5 — CID 56885537

IUPAC5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1ccnc(CNc2cc(-c3ccc(F)cc3)nc3ccnn23)c1
InChIInChI=1S/C19H16FN5/c1-13-6-8-21-16(10-13)12-22-19-11-17(14-2-4-15(20)5-3-14)24-18-7-9-23-25(18)19/h2-11,22H,12H2,1H3
InChIKeyFZXDUAZTXINRSZ-UHFFFAOYSA-N
MW333.37 g/mol
LogP3.85
Rot. Bonds4

About 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56885537) has the molecular formula C19H16FN5 and a molecular weight of 333.37 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56885537
Molecular FormulaC19H16FN5
Molecular Weight333.37 g/mol
Exact Mass333.14
IUPAC Name5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1ccnc(CNc2cc(-c3ccc(F)cc3)nc3ccnn23)c1
InChIInChI=1S/C19H16FN5/c1-13-6-8-21-16(10-13)12-22-19-11-17(14-2-4-15(20)5-3-14)24-18-7-9-23-25(18)19/h2-11,22H,12H2,1H3
InChIKeyFZXDUAZTXINRSZ-UHFFFAOYSA-N
XLogP3.85
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.37
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 56885537) is 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine is Cc1ccnc(CNc2cc(-c3ccc(F)cc3)nc3ccnn23)c1.
What is the InChIKey of 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is FZXDUAZTXINRSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5/c1-13-6-8-21-16(10-13)12-22-19-11-17(14-2-4-15(20)5-3-14)24-18-7-9-23-25(18)19/h2-11,22H,12H2,1H3.
What are the key properties of 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 333.37 g/mol, XLogP of 3.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56885537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).