1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride

C13H23ClN2O — CID 115674040

IUPAC1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride
SMILESCC1CCC(NC2CC(=O)N(C3CC3)C2)C1.Cl
InChIInChI=1S/C13H22N2O.ClH/c1-9-2-3-10(6-9)14-11-7-13(16)15(8-11)12-4-5-12;/h9-12,14H,2-8H2,1H3;1H
InChIKeyMOYKXRFDNZYKAM-UHFFFAOYSA-N
MW258.79 g/mol
LogP1.95
Rot. Bonds3

About 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride

1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride (PubChem CID 115674040) has the molecular formula C13H23ClN2O and a molecular weight of 258.79 g/mol. Its IUPAC name is 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride.

Molecular Properties

Compound Name1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride
PubChem CID115674040
Molecular FormulaC13H23ClN2O
Molecular Weight258.79 g/mol
Exact Mass258.15
IUPAC Name1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride
SMILESCC1CCC(NC2CC(=O)N(C3CC3)C2)C1.Cl
InChIInChI=1S/C13H22N2O.ClH/c1-9-2-3-10(6-9)14-11-7-13(16)15(8-11)12-4-5-12;/h9-12,14H,2-8H2,1H3;1H
InChIKeyMOYKXRFDNZYKAM-UHFFFAOYSA-N
XLogP1.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.79
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride?
The IUPAC name of 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride (CID 115674040) is 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride.
What is the SMILES notation for 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride?
The canonical SMILES for 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride is CC1CCC(NC2CC(=O)N(C3CC3)C2)C1.Cl.
What is the InChIKey of 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride?
The InChIKey is MOYKXRFDNZYKAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O.ClH/c1-9-2-3-10(6-9)14-11-7-13(16)15(8-11)12-4-5-12;/h9-12,14H,2-8H2,1H3;1H.
What are the key properties of 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride?
1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride has a molecular weight of 258.79 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-[(3-methylcyclopentyl)amino]pyrrolidin-2-one;hydrochloride is sourced from PubChem (CID 115674040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).