1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone

C11H13N5O — CID 126946369

IUPAC1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone
SMILESO=C(c1cnc[nH]1)N1CCC(n2cccn2)C1
InChIInChI=1S/C11H13N5O/c17-11(10-6-12-8-13-10)15-5-2-9(7-15)16-4-1-3-14-16/h1,3-4,6,8-9H,2,5,7H2,(H,12,13)
InChIKeyGDSVZTHPHQQVQL-UHFFFAOYSA-N
MW231.26 g/mol
LogP0.69
Rot. Bonds2

About 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone

1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone (PubChem CID 126946369) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone
PubChem CID126946369
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC Name1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone
SMILESO=C(c1cnc[nH]1)N1CCC(n2cccn2)C1
InChIInChI=1S/C11H13N5O/c17-11(10-6-12-8-13-10)15-5-2-9(7-15)16-4-1-3-14-16/h1,3-4,6,8-9H,2,5,7H2,(H,12,13)
InChIKeyGDSVZTHPHQQVQL-UHFFFAOYSA-N
XLogP0.69
TPSA66.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1H-imidazol-5-yl-[(3R)-3-methylpyrrolidin-1-yl]methanone
CID 89293635
1H-indol-4-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone
CID 126946391
3H-benzimidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone
CID 126946356
1-(1H-imidazole-5-carbonyl)piperidine-3,4-dicarboxylic acid
CID 112568032
4-(3-pyrazol-1-ylpyrrolidine-1-carbonyl)-1,3-dihydrobenzimidazol-2-one
CID 138005104
(3-pyrazol-1-ylpyrrolidin-1-yl)-[2-(trifluoromethyl)phenyl]methanone
CID 126946676
N-(3-bicyclo[3.1.0]hexanyl)-3-pyrazol-1-ylpyrrolidine-1-carboxamide
CID 128915883
1H-pyrazol-5-yl-(3-pyrazol-1-ylazetidin-1-yl)methanone
CID 126900110
[(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone
CID 129371649
(4-pyrazol-1-ylpiperidin-1-yl)-(2-sulfanylidene-1H-pyridin-3-yl)methanone
CID 99616335
1-[1-[1-(1H-imidazole-5-carbonyl)azetidin-3-yl]pyrazol-4-yl]pyrrolidin-2-one
CID 126945209
tert-butyl (3S)-3-pyrazol-1-ylpyrrolidine-1-carboxylate
CID 96536772

Frequently Asked Questions

What is the IUPAC name of 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone?
The IUPAC name of 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone (CID 126946369) is 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone.
What is the SMILES notation for 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone?
The canonical SMILES for 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone is O=C(c1cnc[nH]1)N1CCC(n2cccn2)C1.
What is the InChIKey of 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone?
The InChIKey is GDSVZTHPHQQVQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c17-11(10-6-12-8-13-10)15-5-2-9(7-15)16-4-1-3-14-16/h1,3-4,6,8-9H,2,5,7H2,(H,12,13).
What are the key properties of 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone?
1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone has a molecular weight of 231.26 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazol-5-yl-(3-pyrazol-1-ylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 126946369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).