5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine

C20H22N6O — CID 56907604

IUPAC5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NC(C)c2cnn(-c3cccc(OC)c3)c2)n2nccc2n1
InChIInChI=1S/C20H22N6O/c1-4-16-10-20(26-19(24-16)8-9-21-26)23-14(2)15-12-22-25(13-15)17-6-5-7-18(11-17)27-3/h5-14,23H,4H2,1-3H3
InChIKeyZXDGWVBQPGSXAL-UHFFFAOYSA-N
MW362.44 g/mol
LogP3.66
Rot. Bonds6

About 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine

5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56907604) has the molecular formula C20H22N6O and a molecular weight of 362.44 g/mol. Its IUPAC name is 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56907604
Molecular FormulaC20H22N6O
Molecular Weight362.44 g/mol
Exact Mass362.19
IUPAC Name5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NC(C)c2cnn(-c3cccc(OC)c3)c2)n2nccc2n1
InChIInChI=1S/C20H22N6O/c1-4-16-10-20(26-19(24-16)8-9-21-26)23-14(2)15-12-22-25(13-15)17-6-5-7-18(11-17)27-3/h5-14,23H,4H2,1-3H3
InChIKeyZXDGWVBQPGSXAL-UHFFFAOYSA-N
XLogP3.66
TPSA69.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.44
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine with MolForge

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Related Compounds

5-ethyl-N-[(1S)-1-(1-phenylpyrazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95895210
N-[(1R)-1-(3-methoxyphenyl)ethyl]-5-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 56891110
1-[1-(3-methoxyphenyl)pyrazol-4-yl]-N-methylethanamine
CID 105489793
N-[(1R)-1-(2,4-difluorophenyl)ethyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 95870096
4-(4-methoxyphenoxy)-1-(3-methoxyphenyl)pyrazole
CID 117229524
N-methoxy-1-(1-phenylpyrazol-4-yl)ethanamine
CID 82706482
(3-methoxyphenyl)-(1-phenylpyrazol-4-yl)methanol
CID 61088954
2-[1-(3-methoxyphenyl)pyrazol-4-yl]oxyethanamine
CID 117229758
1-ethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]pyrazol-4-amine
CID 81472831
[1-(3-methoxyphenyl)pyrazol-4-yl] hydrogen carbonate
CID 117230396
2-ethylsulfanyl-N-[1-[1-(4-methoxyphenyl)pyrazol-4-yl]ethyl]acetamide
CID 118760994
2-ethylsulfanyl-N-[(1R)-1-[1-(4-methoxyphenyl)pyrazol-4-yl]ethyl]acetamide
CID 125159919

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 56907604) is 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine is CCc1cc(NC(C)c2cnn(-c3cccc(OC)c3)c2)n2nccc2n1.
What is the InChIKey of 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is ZXDGWVBQPGSXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6O/c1-4-16-10-20(26-19(24-16)8-9-21-26)23-14(2)15-12-22-25(13-15)17-6-5-7-18(11-17)27-3/h5-14,23H,4H2,1-3H3.
What are the key properties of 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 362.44 g/mol, XLogP of 3.66, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[1-[1-(3-methoxyphenyl)pyrazol-4-yl]ethyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56907604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).