(2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride

C10H18ClN3O2 — CID 119322682

IUPAC(2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCN1CCC(NC(=O)[C@@H]2CCCN2)C1=O.Cl
InChIInChI=1S/C10H17N3O2.ClH/c1-13-6-4-8(10(13)15)12-9(14)7-3-2-5-11-7;/h7-8,11H,2-6H2,1H3,(H,12,14);1H/t7-,8?;/m0./s1
InChIKeyVLNYFNHILLOBIO-JPPWUZRISA-N
MW247.73 g/mol
LogP-0.49
Rot. Bonds2

About (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride

(2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119322682) has the molecular formula C10H18ClN3O2 and a molecular weight of 247.73 g/mol. Its IUPAC name is (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119322682
Molecular FormulaC10H18ClN3O2
Molecular Weight247.73 g/mol
Exact Mass247.11
IUPAC Name(2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCN1CCC(NC(=O)[C@@H]2CCCN2)C1=O.Cl
InChIInChI=1S/C10H17N3O2.ClH/c1-13-6-4-8(10(13)15)12-9(14)7-3-2-5-11-7;/h7-8,11H,2-6H2,1H3,(H,12,14);1H/t7-,8?;/m0./s1
InChIKeyVLNYFNHILLOBIO-JPPWUZRISA-N
XLogP-0.49
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.73
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methyl-2-oxopyrrolidin-3-yl)azepane-2-carboxamide
CID 104954776
3-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-2-carboxamide
CID 106256043
N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide;hydrochloride
CID 119322684
N-[2-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]pyrrolidine-2-carboxamide
CID 119324335
N-[1-(3,5-dimethoxyphenyl)-2-oxopyrrolidin-3-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 119341782
(3S)-N-(1-methyl-2-oxopyrrolidin-3-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 106255764
(2R)-N-(1-methyl-6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
CID 103796815
N-[1-(2-chlorophenyl)-2-oxopyrrolidin-3-yl]piperidine-2-carboxamide;hydrochloride
CID 119321185
N-[1-(3,5-dimethoxyphenyl)-2-oxopyrrolidin-3-yl]piperidine-2-carboxamide
CID 119341765
N-[1-[2-(hydroxyamino)-2-oxoethyl]-5-methyl-2-oxopyrrolidin-3-yl]pyrrolidine-2-carboxamide
CID 88940230
(2S)-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
CID 66855012
N-(2-oxoazepan-3-yl)pyrrolidine-2-carboxamide
CID 43704078

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride (CID 119322682) is (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride is CN1CCC(NC(=O)[C@@H]2CCCN2)C1=O.Cl.
What is the InChIKey of (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is VLNYFNHILLOBIO-JPPWUZRISA-N. The full InChI is InChI=1S/C10H17N3O2.ClH/c1-13-6-4-8(10(13)15)12-9(14)7-3-2-5-11-7;/h7-8,11H,2-6H2,1H3,(H,12,14);1H/t7-,8?;/m0./s1.
What are the key properties of (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride?
(2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 247.73 g/mol, XLogP of -0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119322682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).