6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile

C12H10FN5 — CID 141152908

IUPAC6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile
SMILESN#Cc1cnc(Nc2cc(C3CC3)[nH]n2)c(F)c1
InChIInChI=1S/C12H10FN5/c13-9-3-7(5-14)6-15-12(9)16-11-4-10(17-18-11)8-1-2-8/h3-4,6,8H,1-2H2,(H2,15,16,17,18)
InChIKeyMMZCCJREEVIHNM-UHFFFAOYSA-N
MW243.24 g/mol
LogP2.44
Rot. Bonds3

About 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile

6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile (PubChem CID 141152908) has the molecular formula C12H10FN5 and a molecular weight of 243.24 g/mol. Its IUPAC name is 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile
PubChem CID141152908
Molecular FormulaC12H10FN5
Molecular Weight243.24 g/mol
Exact Mass243.09
IUPAC Name6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile
SMILESN#Cc1cnc(Nc2cc(C3CC3)[nH]n2)c(F)c1
InChIInChI=1S/C12H10FN5/c13-9-3-7(5-14)6-15-12(9)16-11-4-10(17-18-11)8-1-2-8/h3-4,6,8H,1-2H2,(H2,15,16,17,18)
InChIKeyMMZCCJREEVIHNM-UHFFFAOYSA-N
XLogP2.44
TPSA77.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile
CID 129348328
CID 88969890
CID 88969890
N-(5-cyclopropyl-1H-pyrazol-3-yl)thieno[3,4-d]pyrimidin-4-amine
CID 173150514
N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-fluoro-2-(4-hydroxysulfanylcyclopenta-1,3-dien-1-yl)pyrimidin-4-amine
CID 90381573
N-[5-[1-[[3-cyano-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoro-2-pyridinyl]amino]ethyl]-2-fluorophenyl]cyclopropanecarboxamide
CID 67426455
5-cyclopropyl-1H-pyrazole-3-carbonitrile
CID 39235045
2-N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-fluoro-6-N-[(4-fluorophenyl)methyl]-5-nitropyridine-2,6-diamine
CID 90711232
6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoro-2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]pyridine-3-carbaldehyde
CID 86620610
5-bromo-2-N-(2-bromo-4-fluorophenyl)-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine
CID 59758133
2-[4-[[5-chloro-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]acetonitrile
CID 58169245
2-[4-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]amino]phenoxy]acetonitrile
CID 10178929
[5-[1-(5-cyano-2-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-yl]carbamic acid
CID 118020403

Frequently Asked Questions

What is the IUPAC name of 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile?
The IUPAC name of 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile (CID 141152908) is 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile.
What is the SMILES notation for 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile?
The canonical SMILES for 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile is N#Cc1cnc(Nc2cc(C3CC3)[nH]n2)c(F)c1.
What is the InChIKey of 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile?
The InChIKey is MMZCCJREEVIHNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN5/c13-9-3-7(5-14)6-15-12(9)16-11-4-10(17-18-11)8-1-2-8/h3-4,6,8H,1-2H2,(H2,15,16,17,18).
What are the key properties of 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile?
6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile has a molecular weight of 243.24 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile is sourced from PubChem (CID 141152908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).