2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid

C10H11N3O2 — CID 84734034

IUPAC2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid
SMILESN#Cc1ccnn1C1CCCC1C(=O)O
InChIInChI=1S/C10H11N3O2/c11-6-7-4-5-12-13(7)9-3-1-2-8(9)10(14)15/h4-5,8-9H,1-3H2,(H,14,15)
InChIKeySMAZTHLRDFHDBX-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.18
Rot. Bonds2

About 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid

2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid (PubChem CID 84734034) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid
PubChem CID84734034
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid
SMILESN#Cc1ccnn1C1CCCC1C(=O)O
InChIInChI=1S/C10H11N3O2/c11-6-7-4-5-12-13(7)9-3-1-2-8(9)10(14)15/h4-5,8-9H,1-3H2,(H,14,15)
InChIKeySMAZTHLRDFHDBX-UHFFFAOYSA-N
XLogP1.18
TPSA78.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-cyanopyrazol-1-yl)cyclohexane-1-carboxylic acid
CID 84735163
2-cyclopentylpyrazole-3-carbonitrile
CID 105431659
2-[(2S)-oxan-2-yl]pyrazole-3-carbonitrile
CID 129410450
2-(azetidin-3-yl)pyrazole-3-carbonitrile
CID 84731232
2-(2-propan-2-ylimidazol-1-yl)cyclohexane-1-carboxylic acid
CID 63074431
2-(furo[3,2-c]pyridin-4-ylamino)cyclopentane-1-carboxylic acid
CID 106534894
2-[(6-cyano-2-pyridinyl)amino]cyclopentane-1-carboxylic acid
CID 64817435
2-(1-ethylpyrrolidin-3-yl)pyrazole-3-carbonitrile
CID 105444431
cis-(1R,2S)-2-(1,2,4-triazol-1-yl)cyclohexane-1-carboxylic acid
CID 95008016
cis-(1R,2S)-2-(pyrimidin-2-ylamino)cyclopentane-1-carboxylic acid
CID 164653891
2-(pyrazolo[1,5-a]pyrimidin-5-ylamino)cyclopentane-1-carboxylic acid
CID 113296576
2-(2-methylpyrazol-3-yl)cycloheptane-1-carboxylic acid
CID 81020533

Frequently Asked Questions

What is the IUPAC name of 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid?
The IUPAC name of 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid (CID 84734034) is 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid is N#Cc1ccnn1C1CCCC1C(=O)O.
What is the InChIKey of 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid?
The InChIKey is SMAZTHLRDFHDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c11-6-7-4-5-12-13(7)9-3-1-2-8(9)10(14)15/h4-5,8-9H,1-3H2,(H,14,15).
What are the key properties of 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid?
2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid has a molecular weight of 205.22 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-cyanopyrazol-1-yl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 84734034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).