2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride

C17H26ClN3O2 — CID 119806331

IUPAC2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NC1CC(C)N(c2ccccc2)C1=O.Cl
InChIInChI=1S/C17H25N3O2.ClH/c1-4-10-17(3,18)16(22)19-14-11-12(2)20(15(14)21)13-8-6-5-7-9-13;/h5-9,12,14H,4,10-11,18H2,1-3H3,(H,19,22);1H
InChIKeyKESVBEMNSLNFRC-UHFFFAOYSA-N
MW339.87 g/mol
LogP2.24
Rot. Bonds5

About 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride

2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride (PubChem CID 119806331) has the molecular formula C17H26ClN3O2 and a molecular weight of 339.87 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride
PubChem CID119806331
Molecular FormulaC17H26ClN3O2
Molecular Weight339.87 g/mol
Exact Mass339.17
IUPAC Name2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NC1CC(C)N(c2ccccc2)C1=O.Cl
InChIInChI=1S/C17H25N3O2.ClH/c1-4-10-17(3,18)16(22)19-14-11-12(2)20(15(14)21)13-8-6-5-7-9-13;/h5-9,12,14H,4,10-11,18H2,1-3H3,(H,19,22);1H
InChIKeyKESVBEMNSLNFRC-UHFFFAOYSA-N
XLogP2.24
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.87
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride (CID 119806331) is 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride is CCCC(C)(N)C(=O)NC1CC(C)N(c2ccccc2)C1=O.Cl.
What is the InChIKey of 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride?
The InChIKey is KESVBEMNSLNFRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2.ClH/c1-4-10-17(3,18)16(22)19-14-11-12(2)20(15(14)21)13-8-6-5-7-9-13;/h5-9,12,14H,4,10-11,18H2,1-3H3,(H,19,22);1H.
What are the key properties of 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride?
2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride has a molecular weight of 339.87 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride is sourced from PubChem (CID 119806331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).