pyrrolidine-2-carboxamide;dihydrobromide

C5H12Br2N2O — CID 70056458

IUPACpyrrolidine-2-carboxamide;dihydrobromide
SMILESBr.Br.NC(=O)C1CCCN1
InChIInChI=1S/C5H10N2O.2BrH/c6-5(8)4-2-1-3-7-4;;/h4,7H,1-3H2,(H2,6,8);2*1H
InChIKeyVEKSDNPHPMLEFS-UHFFFAOYSA-N
MW275.97 g/mol
LogP0.38
Rot. Bonds1

About pyrrolidine-2-carboxamide;dihydrobromide

pyrrolidine-2-carboxamide;dihydrobromide (PubChem CID 70056458) has the molecular formula C5H12Br2N2O and a molecular weight of 275.97 g/mol. Its IUPAC name is pyrrolidine-2-carboxamide;dihydrobromide.

Molecular Properties

Compound Namepyrrolidine-2-carboxamide;dihydrobromide
PubChem CID70056458
Molecular FormulaC5H12Br2N2O
Molecular Weight275.97 g/mol
Exact Mass273.93
IUPAC Namepyrrolidine-2-carboxamide;dihydrobromide
SMILESBr.Br.NC(=O)C1CCCN1
InChIInChI=1S/C5H10N2O.2BrH/c6-5(8)4-2-1-3-7-4;;/h4,7H,1-3H2,(H2,6,8);2*1H
InChIKeyVEKSDNPHPMLEFS-UHFFFAOYSA-N
XLogP0.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.97
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

chloromethane;(2R)-pyrrolidine-2-carboxamide
CID 143336240
(2S)-pyrrolidine-2-carboxylic acid;urea
CID 11629677
ethane;2-methylpentane;pyrrolidine-2-carboxamide
CID 177141949
pyrrolidin-2-yl-[(2R)-pyrrolidin-2-yl]methanone
CID 20598954
hydrogen peroxide;(2S)-pyrrolidine-2-carboxylic acid
CID 158114560
pyrrolidine-2-carboxylic acid
CID 614
(213C)azolidine-2-carboxylic acid
CID 10290769
argon;(2S)-pyrrolidine-2-carboxylic acid
CID 160825816
(2S)-5-cyclopropylazepane-2-carboxamide
CID 163441383
bis((2S)-pyrrolidine-2-carboxylic acid);hydrate
CID 67110713
pyrrolidine-2-carboxylic acid;yttrium
CID 21344974
potassium (2R)-pyrrolidine-2-carboxylic acid
CID 177481174

Frequently Asked Questions

What is the IUPAC name of pyrrolidine-2-carboxamide;dihydrobromide?
The IUPAC name of pyrrolidine-2-carboxamide;dihydrobromide (CID 70056458) is pyrrolidine-2-carboxamide;dihydrobromide.
What is the SMILES notation for pyrrolidine-2-carboxamide;dihydrobromide?
The canonical SMILES for pyrrolidine-2-carboxamide;dihydrobromide is Br.Br.NC(=O)C1CCCN1.
What is the InChIKey of pyrrolidine-2-carboxamide;dihydrobromide?
The InChIKey is VEKSDNPHPMLEFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O.2BrH/c6-5(8)4-2-1-3-7-4;;/h4,7H,1-3H2,(H2,6,8);2*1H.
What are the key properties of pyrrolidine-2-carboxamide;dihydrobromide?
pyrrolidine-2-carboxamide;dihydrobromide has a molecular weight of 275.97 g/mol, XLogP of 0.38, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolidine-2-carboxamide;dihydrobromide is sourced from PubChem (CID 70056458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).