4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid

C10H15N3O2 — CID 83909324

IUPAC4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid
SMILESCC(C)c1n[nH]c2c1C(N)(C(=O)O)CC2
InChIInChI=1S/C10H15N3O2/c1-5(2)8-7-6(12-13-8)3-4-10(7,11)9(14)15/h5H,3-4,11H2,1-2H3,(H,12,13)(H,14,15)
InChIKeyVZRSFIWHXYPQFN-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.72
Rot. Bonds2

About 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid

4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid (PubChem CID 83909324) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid.

Molecular Properties

Compound Name4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid
PubChem CID83909324
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid
SMILESCC(C)c1n[nH]c2c1C(N)(C(=O)O)CC2
InChIInChI=1S/C10H15N3O2/c1-5(2)8-7-6(12-13-8)3-4-10(7,11)9(14)15/h5H,3-4,11H2,1-2H3,(H,12,13)(H,14,15)
InChIKeyVZRSFIWHXYPQFN-UHFFFAOYSA-N
XLogP0.72
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-Propyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid
CID 49862072
5-Isopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid
CID 49862073
6-Propyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid
CID 44441316
5-Sec-butyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid
CID 49862074
5-Methyl-1,4,5,6-tetrahydrocyclopenta[C]pyrazole-3-carboxylic acid
CID 25033881
2-{1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}acetic acid
CID 83858867
2-[5,5-difluoro-3-(trifluoromethyl)-4,6-dihydro-1H-cyclopenta[c]pyrazol-4-yl]acetic acid
CID 71185034
2-[4,4-difluoro-3-(trifluoromethyl)-5,6-dihydro-1H-cyclopenta[c]pyrazol-5-yl]acetic acid
CID 71185055
3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid
CID 83861625
2-[3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-yl]acetic acid
CID 83861629
5-amino-3-(trifluoromethyl)-4,6-dihydro-1H-cyclopenta[d]pyrazole-5-carboxylic acid
CID 112483025
3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-5-carboxylic acid
CID 112485977

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid?
The IUPAC name of 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid (CID 83909324) is 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid.
What is the SMILES notation for 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid?
The canonical SMILES for 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid is CC(C)c1n[nH]c2c1C(N)(C(=O)O)CC2.
What is the InChIKey of 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid?
The InChIKey is VZRSFIWHXYPQFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-5(2)8-7-6(12-13-8)3-4-10(7,11)9(14)15/h5H,3-4,11H2,1-2H3,(H,12,13)(H,14,15).
What are the key properties of 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid?
4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid has a molecular weight of 209.25 g/mol, XLogP of 0.72, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-propan-2-yl-5,6-dihydro-1H-cyclopenta[c]pyrazole-4-carboxylic acid is sourced from PubChem (CID 83909324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).