2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide

C11H23N3O — CID 64711973

IUPAC2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide
SMILESCC1CCN(C(C)CC(C)(N)C(N)=O)C1
InChIInChI=1S/C11H23N3O/c1-8-4-5-14(7-8)9(2)6-11(3,13)10(12)15/h8-9H,4-7,13H2,1-3H3,(H2,12,15)
InChIKeyWUOMMCVGBNECCN-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.31
Rot. Bonds4

About 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide

2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide (PubChem CID 64711973) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide.

Molecular Properties

Compound Name2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide
PubChem CID64711973
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide
SMILESCC1CCN(C(C)CC(C)(N)C(N)=O)C1
InChIInChI=1S/C11H23N3O/c1-8-4-5-14(7-8)9(2)6-11(3,13)10(12)15/h8-9H,4-7,13H2,1-3H3,(H2,12,15)
InChIKeyWUOMMCVGBNECCN-UHFFFAOYSA-N
XLogP0.31
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.31
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-4-(3-methylpyrrolidin-1-yl)pentanamide?
The IUPAC name of 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide (CID 64711973) is 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide.
What is the SMILES notation for 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide?
The canonical SMILES for 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide is CC1CCN(C(C)CC(C)(N)C(N)=O)C1.
What is the InChIKey of 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide?
The InChIKey is WUOMMCVGBNECCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-8-4-5-14(7-8)9(2)6-11(3,13)10(12)15/h8-9H,4-7,13H2,1-3H3,(H2,12,15).
What are the key properties of 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide?
2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide has a molecular weight of 213.32 g/mol, XLogP of 0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)pentanamide is sourced from PubChem (CID 64711973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).