N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide

C13H15N5O — CID 63005414

IUPACN-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc(-n2ccnc2)nc1)C1CCNC1
InChIInChI=1S/C13H15N5O/c19-13(10-3-4-14-7-10)17-11-1-2-12(16-8-11)18-6-5-15-9-18/h1-2,5-6,8-10,14H,3-4,7H2,(H,17,19)
InChIKeySXZRASYOZONCJK-UHFFFAOYSA-N
MW257.30 g/mol
LogP0.82
Rot. Bonds3

About N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide

N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide (PubChem CID 63005414) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide
PubChem CID63005414
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC NameN-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc(-n2ccnc2)nc1)C1CCNC1
InChIInChI=1S/C13H15N5O/c19-13(10-3-4-14-7-10)17-11-1-2-12(16-8-11)18-6-5-15-9-18/h1-2,5-6,8-10,14H,3-4,7H2,(H,17,19)
InChIKeySXZRASYOZONCJK-UHFFFAOYSA-N
XLogP0.82
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(6-imidazol-1-yl-3-pyridinyl)cyclohexane-1-carboxamide
CID 64822564
N-(6-imidazol-1-yl-3-pyridinyl)morpholine-3-carboxamide;dihydrochloride
CID 119846823
N-(6-imidazol-1-yl-3-pyridinyl)-2-morpholin-2-ylacetamide;dihydrochloride
CID 119846852
N-pyridin-4-ylpyrrolidine-3-carboxamide
CID 63005932
2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide
CID 60867461
N-(6-imidazol-1-yl-3-pyridinyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 55632262
N-(6-imidazol-1-yl-3-pyridinyl)-2-methylpropanamide
CID 35437698
2-imidazol-1-yl-5-[[(3R)-pyrrolidin-3-yl]methyl]pyridine
CID 124980656
(3S)-N-(2-imidazol-1-ylphenyl)piperidine-3-carboxamide
CID 81123663
1-(4-chlorophenyl)-3-(6-imidazol-1-yl-3-pyridinyl)urea
CID 90564862
N-(6-imidazol-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide
CID 60965851
N-[6-(2-methoxyethoxy)-3-pyridinyl]pyrrolidine-3-carboxamide
CID 55150610

Frequently Asked Questions

What is the IUPAC name of N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide (CID 63005414) is N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide is O=C(Nc1ccc(-n2ccnc2)nc1)C1CCNC1.
What is the InChIKey of N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide?
The InChIKey is SXZRASYOZONCJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c19-13(10-3-4-14-7-10)17-11-1-2-12(16-8-11)18-6-5-15-9-18/h1-2,5-6,8-10,14H,3-4,7H2,(H,17,19).
What are the key properties of N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide?
N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide has a molecular weight of 257.30 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 63005414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).