N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride

C11H21ClN2O2 — CID 119814558

IUPACN-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCN(CC1CCOC1)C(=O)C1CCNC1.Cl
InChIInChI=1S/C11H20N2O2.ClH/c1-13(7-9-3-5-15-8-9)11(14)10-2-4-12-6-10;/h9-10,12H,2-8H2,1H3;1H
InChIKeyPPCGKEQRNCJLOB-UHFFFAOYSA-N
MW248.75 g/mol
LogP0.51
Rot. Bonds3

About N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride

N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 119814558) has the molecular formula C11H21ClN2O2 and a molecular weight of 248.75 g/mol. Its IUPAC name is N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride
PubChem CID119814558
Molecular FormulaC11H21ClN2O2
Molecular Weight248.75 g/mol
Exact Mass248.13
IUPAC NameN-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCN(CC1CCOC1)C(=O)C1CCNC1.Cl
InChIInChI=1S/C11H20N2O2.ClH/c1-13(7-9-3-5-15-8-9)11(14)10-2-4-12-6-10;/h9-10,12H,2-8H2,1H3;1H
InChIKeyPPCGKEQRNCJLOB-UHFFFAOYSA-N
XLogP0.51
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.75
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(oxan-3-ylmethyl)piperidine-3-carboxamide
CID 55227214
(3S)-N-methyl-N-(oxan-4-ylmethyl)piperidine-3-carboxamide
CID 81140981
N-methyl-N-(piperidin-3-ylmethyl)oxolane-3-carboxamide
CID 106627645
N-cyclopropyl-N-(oxolan-3-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 119284851
N-methyl-N-[2-(oxan-4-yl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119331855
N-methyl-N-(oxolan-3-ylmethyl)acetamide
CID 129016783
N-[2-(dimethylamino)-2-oxoethyl]-N-methylpyrrolidine-3-carboxamide;hydrochloride
CID 119687382
N-methyl-2-(oxolan-3-yl)-N-pyrrolidin-3-ylacetamide
CID 119551379
1,3-dimethyl-1-[[(3S)-oxolan-3-yl]methyl]urea
CID 163816588
N-(2,2-dimethylpropyl)-N-methylpyrrolidine-3-carboxamide
CID 63005495
N-methyl-N-(oxan-4-ylmethyl)cyclohexanecarboxamide
CID 110752395
N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride
CID 119932323

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride (CID 119814558) is N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride is CN(CC1CCOC1)C(=O)C1CCNC1.Cl.
What is the InChIKey of N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is PPCGKEQRNCJLOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2.ClH/c1-13(7-9-3-5-15-8-9)11(14)10-2-4-12-6-10;/h9-10,12H,2-8H2,1H3;1H.
What are the key properties of N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride?
N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 248.75 g/mol, XLogP of 0.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119814558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).