(3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride

C10H19ClN2O2 — CID 130747909

IUPAC(3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCC1OCCC1NC(=O)[C@H]1CCNC1.Cl
InChIInChI=1S/C10H18N2O2.ClH/c1-7-9(3-5-14-7)12-10(13)8-2-4-11-6-8;/h7-9,11H,2-6H2,1H3,(H,12,13);1H/t7?,8-,9?;/m0./s1
InChIKeyFCFJYWLVLLJMNB-SUBRPDEISA-N
MW234.73 g/mol
LogP0.31
Rot. Bonds2

About (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride

(3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 130747909) has the molecular formula C10H19ClN2O2 and a molecular weight of 234.73 g/mol. Its IUPAC name is (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name(3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride
PubChem CID130747909
Molecular FormulaC10H19ClN2O2
Molecular Weight234.73 g/mol
Exact Mass234.11
IUPAC Name(3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCC1OCCC1NC(=O)[C@H]1CCNC1.Cl
InChIInChI=1S/C10H18N2O2.ClH/c1-7-9(3-5-14-7)12-10(13)8-2-4-11-6-8;/h7-9,11H,2-6H2,1H3,(H,12,13);1H/t7?,8-,9?;/m0./s1
InChIKeyFCFJYWLVLLJMNB-SUBRPDEISA-N
XLogP0.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.73
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylcyclopropyl)pyrrolidine-3-carboxamide
CID 63006462
6-methyl-N-(2-methyloxolan-3-yl)piperidine-3-carboxamide
CID 82729344
N-(2-methyloxolan-3-yl)piperazine-2-carboxamide
CID 82728047
N-(4-methyloxolan-3-yl)pyrrolidine-3-carboxamide
CID 164659164
N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide
CID 82841949
3-[(2-methyloxolan-3-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103551068
(3S)-N-(2-ethylcyclopropyl)pyrrolidine-3-carboxamide;hydrochloride
CID 131089746
N-(2-methylthiolan-3-yl)pyrrolidine-3-carboxamide
CID 130624332
2-(pyrrolidine-3-carbonylamino)cyclohexane-1-carboxylic acid
CID 64817965
2-(pyrrolidine-3-carbonylamino)cyclopentane-1-carboxylic acid
CID 64814811
N-[(3R,4S)-4-hydroxyoxolan-3-yl]pyrrolidine-3-carboxamide
CID 130688496
2-methyl-N-[(3R)-pyrrolidin-3-yl]oxolane-3-carboxamide
CID 79763327

Frequently Asked Questions

What is the IUPAC name of (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride (CID 130747909) is (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride is CC1OCCC1NC(=O)[C@H]1CCNC1.Cl.
What is the InChIKey of (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is FCFJYWLVLLJMNB-SUBRPDEISA-N. The full InChI is InChI=1S/C10H18N2O2.ClH/c1-7-9(3-5-14-7)12-10(13)8-2-4-11-6-8;/h7-9,11H,2-6H2,1H3,(H,12,13);1H/t7?,8-,9?;/m0./s1.
What are the key properties of (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride?
(3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 234.73 g/mol, XLogP of 0.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-(2-methyloxolan-3-yl)pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 130747909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).