N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride

C7H15ClN2O — CID 119011345

IUPACN-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride
SMILESCC(=O)N(C)[C@H]1CCNC1.Cl
InChIInChI=1S/C7H14N2O.ClH/c1-6(10)9(2)7-3-4-8-5-7;/h7-8H,3-5H2,1-2H3;1H/t7-;/m0./s1
InChIKeyDZPRWZNOJJPSLX-FJXQXJEOSA-N
MW178.66 g/mol
LogP0.25
Rot. Bonds1

About N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride

N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride (PubChem CID 119011345) has the molecular formula C7H15ClN2O and a molecular weight of 178.66 g/mol. Its IUPAC name is N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride
PubChem CID119011345
Molecular FormulaC7H15ClN2O
Molecular Weight178.66 g/mol
Exact Mass178.09
IUPAC NameN-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride
SMILESCC(=O)N(C)[C@H]1CCNC1.Cl
InChIInChI=1S/C7H14N2O.ClH/c1-6(10)9(2)7-3-4-8-5-7;/h7-8H,3-5H2,1-2H3;1H/t7-;/m0./s1
InChIKeyDZPRWZNOJJPSLX-FJXQXJEOSA-N
XLogP0.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.66
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-pyrrolidin-3-ylacetamide;dihydrochloride
CID 174958940
N-methyl-N-pyrrolidin-3-ylacetamide;2,2,2-trifluoroacetic acid
CID 156620205
methyl-[(3S)-pyrrolidin-3-yl]carbamic acid
CID 66936290
N-methyl-N-pyrrolidin-3-ylpropanamide
CID 60807525
(3S)-N-methyl-N-pyrrolidin-3-ylpyrrolidine-3-carboxamide
CID 131110681
N-cyclopropyl-N-pyrrolidin-3-ylacetamide
CID 66569466
N-methyl-N-pyrrolidin-3-ylprop-2-ynamide
CID 63297797
N,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide;hydrochloride
CID 119554778
4-acetamido-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119549858
2-[methyl(pyrrolidin-3-yl)amino]-2-oxoethanesulfinic acid
CID 84674319
2-cyclohexyl-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119260670
N-methyl-3-methylsulfanyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119553749

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride?
The IUPAC name of N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride (CID 119011345) is N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride.
What is the SMILES notation for N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride?
The canonical SMILES for N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride is CC(=O)N(C)[C@H]1CCNC1.Cl.
What is the InChIKey of N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride?
The InChIKey is DZPRWZNOJJPSLX-FJXQXJEOSA-N. The full InChI is InChI=1S/C7H14N2O.ClH/c1-6(10)9(2)7-3-4-8-5-7;/h7-8H,3-5H2,1-2H3;1H/t7-;/m0./s1.
What are the key properties of N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride?
N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride has a molecular weight of 178.66 g/mol, XLogP of 0.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride is sourced from PubChem (CID 119011345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).