6-pyrrolidin-1-ylpyridine-3-carboximidamide

C10H14N4 — CID 24696698

IUPAC6-pyrrolidin-1-ylpyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCCC2)nc1
InChIInChI=1S/C10H14N4/c11-10(12)8-3-4-9(13-7-8)14-5-1-2-6-14/h3-4,7H,1-2,5-6H2,(H3,11,12)
InChIKeyODFQDBVKPBIKBH-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.97
Rot. Bonds2

About 6-pyrrolidin-1-ylpyridine-3-carboximidamide

6-pyrrolidin-1-ylpyridine-3-carboximidamide (PubChem CID 24696698) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 6-pyrrolidin-1-ylpyridine-3-carboximidamide.

Molecular Properties

Compound Name6-pyrrolidin-1-ylpyridine-3-carboximidamide
PubChem CID24696698
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name6-pyrrolidin-1-ylpyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCCC2)nc1
InChIInChI=1S/C10H14N4/c11-10(12)8-3-4-9(13-7-8)14-5-1-2-6-14/h3-4,7H,1-2,5-6H2,(H3,11,12)
InChIKeyODFQDBVKPBIKBH-UHFFFAOYSA-N
XLogP0.97
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-pyrrolidin-1-ylpyridine-3-carboximidamide?
The IUPAC name of 6-pyrrolidin-1-ylpyridine-3-carboximidamide (CID 24696698) is 6-pyrrolidin-1-ylpyridine-3-carboximidamide.
What is the SMILES notation for 6-pyrrolidin-1-ylpyridine-3-carboximidamide?
The canonical SMILES for 6-pyrrolidin-1-ylpyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(N2CCCC2)nc1.
What is the InChIKey of 6-pyrrolidin-1-ylpyridine-3-carboximidamide?
The InChIKey is ODFQDBVKPBIKBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c11-10(12)8-3-4-9(13-7-8)14-5-1-2-6-14/h3-4,7H,1-2,5-6H2,(H3,11,12).
What are the key properties of 6-pyrrolidin-1-ylpyridine-3-carboximidamide?
6-pyrrolidin-1-ylpyridine-3-carboximidamide has a molecular weight of 190.25 g/mol, XLogP of 0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrrolidin-1-ylpyridine-3-carboximidamide is sourced from PubChem (CID 24696698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).