1-methylpyrrolidine-2-carboxamide;hydrochloride

C6H13ClN2O — CID 66716063

IUPAC1-methylpyrrolidine-2-carboxamide;hydrochloride
SMILESCN1CCCC1C(N)=O.Cl
InChIInChI=1S/C6H12N2O.ClH/c1-8-4-2-3-5(8)6(7)9;/h5H,2-4H2,1H3,(H2,7,9);1H
InChIKeyUKZRYKLDIZGUOL-UHFFFAOYSA-N
MW164.64 g/mol
LogP-0.01
Rot. Bonds1

About 1-methylpyrrolidine-2-carboxamide;hydrochloride

1-methylpyrrolidine-2-carboxamide;hydrochloride (PubChem CID 66716063) has the molecular formula C6H13ClN2O and a molecular weight of 164.64 g/mol. Its IUPAC name is 1-methylpyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-methylpyrrolidine-2-carboxamide;hydrochloride
PubChem CID66716063
Molecular FormulaC6H13ClN2O
Molecular Weight164.64 g/mol
Exact Mass164.07
IUPAC Name1-methylpyrrolidine-2-carboxamide;hydrochloride
SMILESCN1CCCC1C(N)=O.Cl
InChIInChI=1S/C6H12N2O.ClH/c1-8-4-2-3-5(8)6(7)9;/h5H,2-4H2,1H3,(H2,7,9);1H
InChIKeyUKZRYKLDIZGUOL-UHFFFAOYSA-N
XLogP-0.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.64
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-methylpyrrolidine-2-carboxamide
CID 14245857
ethane;1-methylpiperidine-2-carboxamide
CID 143592848
(2S)-1-methylpyrrolidine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 68577881
(2S)-1-methylazetidine-2-carboxamide
CID 59708444
2-amino-1-(1-methylpyrrolidin-2-yl)ethanone
CID 83479164
(2S)-1-methyl-N-pentan-3-ylpyrrolidine-2-carboxamide;(2S)-1-methylpyrrolidine-2-carboxamide
CID 158518275
(2S)-1-methylpyrrolidine-2-carboxylic acid
CID 158548617
1-(1-methylpyrrolidin-2-yl)ethenamine
CID 143166918
1-methylpyrrolidine-2-carboxylic acid;hydrate
CID 2849411
(2S)-1-methylpyrrolidine-2-carbohydrazide
CID 12522151
2-methylguanidine;1-(1-methylpyrrolidin-2-yl)ethanone
CID 143816509
potassium (2S)-1-methylpyrrolidine-2-carboxylate
CID 169244754

Frequently Asked Questions

What is the IUPAC name of 1-methylpyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of 1-methylpyrrolidine-2-carboxamide;hydrochloride (CID 66716063) is 1-methylpyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for 1-methylpyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for 1-methylpyrrolidine-2-carboxamide;hydrochloride is CN1CCCC1C(N)=O.Cl.
What is the InChIKey of 1-methylpyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is UKZRYKLDIZGUOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.ClH/c1-8-4-2-3-5(8)6(7)9;/h5H,2-4H2,1H3,(H2,7,9);1H.
What are the key properties of 1-methylpyrrolidine-2-carboxamide;hydrochloride?
1-methylpyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 164.64 g/mol, XLogP of -0.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylpyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 66716063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).