5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide

C15H25N5 — CID 63751873

IUPAC5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide
SMILES[H]/N=C(\N)c1c(C)nn(C)c1N1CCCC1C1CCCC1
InChIInChI=1S/C15H25N5/c1-10-13(14(16)17)15(19(2)18-10)20-9-5-8-12(20)11-6-3-4-7-11/h11-12H,3-9H2,1-2H3,(H3,16,17)
InChIKeyYKWGUAXOJISQBQ-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.17
Rot. Bonds3

About 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide

5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide (PubChem CID 63751873) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide.

Molecular Properties

Compound Name5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide
PubChem CID63751873
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide
SMILES[H]/N=C(\N)c1c(C)nn(C)c1N1CCCC1C1CCCC1
InChIInChI=1S/C15H25N5/c1-10-13(14(16)17)15(19(2)18-10)20-9-5-8-12(20)11-6-3-4-7-11/h11-12H,3-9H2,1-2H3,(H3,16,17)
InChIKeyYKWGUAXOJISQBQ-UHFFFAOYSA-N
XLogP2.17
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazole-4-carboximidamide
CID 63751697
5-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-1,3-dimethylpyrazole-4-carboximidamide
CID 63751199
1,3-dimethyl-5-(3-methylpiperidin-1-yl)pyrazole-4-carboximidamide
CID 63752202
5-(4-cyclopropylpiperazin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide
CID 55243294
5-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-1,3-dimethylpyrazole-4-carboximidamide
CID 63752216
5-(3-hydroxypyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide
CID 63751371
2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-4-methylpyridine-3-carboximidamide
CID 102726609
5-(2,2-dimethylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide
CID 55241171
5-[4-(1-hydroxyethyl)piperidin-1-yl]-1,3-dimethylpyrazole-4-carboximidamide
CID 106836120
5-cyclopentylsulfanyl-1,3-dimethylpyrazole-4-carboximidamide
CID 63750570
5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-1,3-dimethylpyrazole-4-carbonitrile
CID 65320667
5-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 66016774

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide?
The IUPAC name of 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide (CID 63751873) is 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide.
What is the SMILES notation for 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide?
The canonical SMILES for 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide is [H]/N=C(\N)c1c(C)nn(C)c1N1CCCC1C1CCCC1.
What is the InChIKey of 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide?
The InChIKey is YKWGUAXOJISQBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-10-13(14(16)17)15(19(2)18-10)20-9-5-8-12(20)11-6-3-4-7-11/h11-12H,3-9H2,1-2H3,(H3,16,17).
What are the key properties of 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide?
5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide has a molecular weight of 275.40 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclopentylpyrrolidin-1-yl)-1,3-dimethylpyrazole-4-carboximidamide is sourced from PubChem (CID 63751873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).