1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole

C10H15FN2 — CID 126848003

IUPAC1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole
SMILESCc1cnn(CC2(F)CCCC2)c1
InChIInChI=1S/C10H15FN2/c1-9-6-12-13(7-9)8-10(11)4-2-3-5-10/h6-7H,2-5,8H2,1H3
InChIKeyNFAPQVPZVMGFQO-UHFFFAOYSA-N
MW182.24 g/mol
LogP2.47
Rot. Bonds2

About 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole

1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole (PubChem CID 126848003) has the molecular formula C10H15FN2 and a molecular weight of 182.24 g/mol. Its IUPAC name is 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole.

Molecular Properties

Compound Name1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole
PubChem CID126848003
Molecular FormulaC10H15FN2
Molecular Weight182.24 g/mol
Exact Mass182.12
IUPAC Name1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole
SMILESCc1cnn(CC2(F)CCCC2)c1
InChIInChI=1S/C10H15FN2/c1-9-6-12-13(7-9)8-10(11)4-2-3-5-10/h6-7H,2-5,8H2,1H3
InChIKeyNFAPQVPZVMGFQO-UHFFFAOYSA-N
XLogP2.47
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-4-ethynyl-1H-pyrazole
CID 122240536
1-Cyclopentyl-1h-pyrazole-4-carbonitrile
CID 83814234
1-[(4,4-Difluorocyclohexyl)methyl]pyrazole-4-carbonitrile
CID 126790427
1-Methyl-4-[(3,3,4,4-tetrafluoropyrrolidin-1-yl)methyl]pyrazole
CID 126818442
1-(2-Methylpropyl)-4-(trifluoromethyl)pyrazole
CID 20696771
1-(2,2-Difluoroethyl)-4-methylpyrazole
CID 58206233
4-(Fluoromethyl)-1-methylpyrazole
CID 58297065
1-[(2,2-Difluorocyclopropyl)methyl]-4-methylpyrazole
CID 58496292
1-(2-Cyclopropyl-2,2-difluoroethyl)-4-methylpyrazole
CID 58496302
1-(2-fluoroethyl)-4-methyl-1H-pyrazole
CID 58514736
1-(Fluoromethyl)-4-methylpyrazole
CID 60209530
1-(2-Fluoropropyl)-4-propan-2-ylpyrazole
CID 68044694

Frequently Asked Questions

What is the IUPAC name of 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole?
The IUPAC name of 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole (CID 126848003) is 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole.
What is the SMILES notation for 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole?
The canonical SMILES for 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole is Cc1cnn(CC2(F)CCCC2)c1.
What is the InChIKey of 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole?
The InChIKey is NFAPQVPZVMGFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2/c1-9-6-12-13(7-9)8-10(11)4-2-3-5-10/h6-7H,2-5,8H2,1H3.
What are the key properties of 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole?
1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole has a molecular weight of 182.24 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-fluorocyclopentyl)methyl]-4-methylpyrazole is sourced from PubChem (CID 126848003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).