1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid

C12H15F3N4O3 — CID 69193042

IUPAC1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid
SMILESNC(=O)c1nn(C2CC2)c2c1CNCC2.O=C(O)C(F)(F)F
InChIInChI=1S/C10H14N4O.C2HF3O2/c11-10(15)9-7-5-12-4-3-8(7)14(13-9)6-1-2-6;3-2(4,5)1(6)7/h6,12H,1-5H2,(H2,11,15);(H,6,7)
InChIKeyHHTHMHSHJDWLKR-UHFFFAOYSA-N
MW320.27 g/mol
LogP0.60
Rot. Bonds2

About 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid

1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid (PubChem CID 69193042) has the molecular formula C12H15F3N4O3 and a molecular weight of 320.27 g/mol. Its IUPAC name is 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Name1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid
PubChem CID69193042
Molecular FormulaC12H15F3N4O3
Molecular Weight320.27 g/mol
Exact Mass320.11
IUPAC Name1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid
SMILESNC(=O)c1nn(C2CC2)c2c1CNCC2.O=C(O)C(F)(F)F
InChIInChI=1S/C10H14N4O.C2HF3O2/c11-10(15)9-7-5-12-4-3-8(7)14(13-9)6-1-2-6;3-2(4,5)1(6)7/h6,12H,1-5H2,(H2,11,15);(H,6,7)
InChIKeyHHTHMHSHJDWLKR-UHFFFAOYSA-N
XLogP0.60
TPSA110.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.27
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-Cyclohexyl-1-(cyclopropylmethyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-C]pyridine-3-carboxamide
CID 124052718
N-cyclopentyl-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 28274917
N-(cyclopropylmethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 118745557
N,N-dimethyl-1-(3,3,3-trifluoropropyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 118759603
N-cyclopentyl-1-isobutyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 118759604
N-cyclopropyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide trifluoroacetate
CID 68940135
2-(4-oxo-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-1-yl)acetic acid
CID 71187012
2,3-dimethyl-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridine trifluoroacetic acid salt
CID 86700289
1,3-dimethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine trifluoroacetic acid salt
CID 86700290
1-(hydroxymethyl)-3-(trifluoromethyl)-5,6-dihydro-4H-pyrazolo[5,4-c]pyridin-7-one
CID 141413704
13-Methyl-11-(trifluoromethyl)-4,8,9,12,13-pentazatricyclo[7.5.0.02,7]tetradeca-1,7,11-trien-14-one
CID 141725199
11,11-Difluoro-13-methyl-4,8,9,13-tetrazatricyclo[7.5.0.02,7]tetradeca-1,7-dien-14-one
CID 146625507

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid?
The IUPAC name of 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid (CID 69193042) is 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid.
What is the SMILES notation for 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid?
The canonical SMILES for 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid is NC(=O)c1nn(C2CC2)c2c1CNCC2.O=C(O)C(F)(F)F.
What is the InChIKey of 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid?
The InChIKey is HHTHMHSHJDWLKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O.C2HF3O2/c11-10(15)9-7-5-12-4-3-8(7)14(13-9)6-1-2-6;3-2(4,5)1(6)7/h6,12H,1-5H2,(H2,11,15);(H,6,7).
What are the key properties of 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid?
1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid has a molecular weight of 320.27 g/mol, XLogP of 0.60, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 69193042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).