2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile

C20H16FN7 — CID 56869931

IUPAC2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile
SMILESCCn1cc(-c2cc(-c3cnn(-c4ccc(F)cc4)c3)nc(N)c2C#N)cn1
InChIInChI=1S/C20H16FN7/c1-2-27-11-13(9-24-27)17-7-19(26-20(23)18(17)8-22)14-10-25-28(12-14)16-5-3-15(21)4-6-16/h3-7,9-12H,2H2,1H3,(H2,23,26)
InChIKeyUHEVEKPRSZRQKT-UHFFFAOYSA-N
MW373.40 g/mol
LogP3.41
Rot. Bonds4

About 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile

2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile (PubChem CID 56869931) has the molecular formula C20H16FN7 and a molecular weight of 373.40 g/mol. Its IUPAC name is 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile
PubChem CID56869931
Molecular FormulaC20H16FN7
Molecular Weight373.40 g/mol
Exact Mass373.15
IUPAC Name2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile
SMILESCCn1cc(-c2cc(-c3cnn(-c4ccc(F)cc4)c3)nc(N)c2C#N)cn1
InChIInChI=1S/C20H16FN7/c1-2-27-11-13(9-24-27)17-7-19(26-20(23)18(17)8-22)14-10-25-28(12-14)16-5-3-15(21)4-6-16/h3-7,9-12H,2H2,1H3,(H2,23,26)
InChIKeyUHEVEKPRSZRQKT-UHFFFAOYSA-N
XLogP3.41
TPSA98.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.40
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-amino-4-(3-hydroxyphenyl)-6-[1-(4-methoxyphenyl)pyrazol-4-yl]pyridine-3-carbonitrile
CID 56879979
2-amino-4-(4-fluorophenyl)-6-pyridin-4-ylpyridine-3-carbonitrile
CID 4636653
4-[6-amino-5-cyano-4-(1-prop-2-enylpyrazol-4-yl)-2-pyridinyl]benzoic acid
CID 56876008
6-(1-ethylpyrazol-4-yl)pyrimidine-2,4-diamine
CID 106878454
2-amino-6-(3-methyl-1-propylpyrazol-4-yl)-4-(1-propan-2-ylpyrazol-4-yl)pyridine-3-carbonitrile
CID 56880822
2-amino-4-(2-fluorophenyl)-6-(4-fluorophenyl)pyridine-3-carbonitrile
CID 3355373
2-(1-ethylpyrazol-4-yl)-4-fluoropyridine
CID 102824444
2-amino-6-(4-fluorophenyl)-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile
CID 665592
2-amino-6-(4-fluorophenyl)-4-[4-(trifluoromethoxy)phenyl]pyridine-3-carbonitrile
CID 3362049
2-amino-4-(4-fluorophenyl)-6-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-carbonitrile
CID 56865430
2-amino-4-(3-bromo-4-methoxyphenyl)-6-(4-fluorophenyl)pyridine-3-carbonitrile
CID 3360582
4-(difluoromethyl)-6-(1-ethylpyrazol-4-yl)-1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridine
CID 29090665

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile (CID 56869931) is 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile is CCn1cc(-c2cc(-c3cnn(-c4ccc(F)cc4)c3)nc(N)c2C#N)cn1.
What is the InChIKey of 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile?
The InChIKey is UHEVEKPRSZRQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN7/c1-2-27-11-13(9-24-27)17-7-19(26-20(23)18(17)8-22)14-10-25-28(12-14)16-5-3-15(21)4-6-16/h3-7,9-12H,2H2,1H3,(H2,23,26).
What are the key properties of 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile?
2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile has a molecular weight of 373.40 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(1-ethylpyrazol-4-yl)-6-[1-(4-fluorophenyl)pyrazol-4-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 56869931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).