(5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid

C7H9N3O2 — CID 99996666

IUPAC(5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid
SMILESN[C@H]1Cc2[nH]nc(C(=O)O)c2C1
InChIInChI=1S/C7H9N3O2/c8-3-1-4-5(2-3)9-10-6(4)7(11)12/h3H,1-2,8H2,(H,9,10)(H,11,12)/t3-/m1/s1
InChIKeyVFWXMFFANYUXPB-GSVOUGTGSA-N
MW167.17 g/mol
LogP-0.47
Rot. Bonds1

About (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid

(5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid (PubChem CID 99996666) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid.

Molecular Properties

Compound Name(5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid
PubChem CID99996666
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name(5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid
SMILESN[C@H]1Cc2[nH]nc(C(=O)O)c2C1
InChIInChI=1S/C7H9N3O2/c8-3-1-4-5(2-3)9-10-6(4)7(11)12/h3H,1-2,8H2,(H,9,10)(H,11,12)/t3-/m1/s1
InChIKeyVFWXMFFANYUXPB-GSVOUGTGSA-N
XLogP-0.47
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-0.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-fluoro-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
CID 83854750
1,4,5,6,7,8-hexahydropyrazolo[4,5-d]azepine-3-carboxylic acid
CID 83862837
5-pyrazol-1-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid
CID 12003601
5,5-difluoro-5a-methyl-1,4,4a,6-tetrahydrocyclopropa[f]indazole-3-carboxylic acid
CID 90036831
(4aS)-5,5-difluoro-5a-methyl-1,4,4a,6-tetrahydrocyclopropa[f]indazole-3-carboxylic acid;ethane
CID 166113355
ethyl 5-amino-4,5,6,7-tetrahydro-1H-indazole-3-carboxylate
CID 23005640
5-cyclopropyl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-3-carboxylic acid
CID 83915632
(2S,4R)-3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene-7-carboxylic acid
CID 57413452
(2S,3S,4R)-3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene-7-carboxylic acid;(2S,3R,4R)-3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene-7-carboxylic acid
CID 161073626
5-(2,3,5-trifluorophenyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
CID 12003787
5-(2-methoxy-3-pyridinyl)-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid
CID 12003491
6-acetyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 110447010

Frequently Asked Questions

What is the IUPAC name of (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid?
The IUPAC name of (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid (CID 99996666) is (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid.
What is the SMILES notation for (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid?
The canonical SMILES for (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid is N[C@H]1Cc2[nH]nc(C(=O)O)c2C1.
What is the InChIKey of (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid?
The InChIKey is VFWXMFFANYUXPB-GSVOUGTGSA-N. The full InChI is InChI=1S/C7H9N3O2/c8-3-1-4-5(2-3)9-10-6(4)7(11)12/h3H,1-2,8H2,(H,9,10)(H,11,12)/t3-/m1/s1.
What are the key properties of (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid?
(5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid has a molecular weight of 167.17 g/mol, XLogP of -0.47, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-amino-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxylic acid is sourced from PubChem (CID 99996666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).