2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide

C12H22N2O — CID 123486269

IUPAC2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide
SMILESCC1CC(CN2CCCC2(C)C(N)=O)C1
InChIInChI=1S/C12H22N2O/c1-9-6-10(7-9)8-14-5-3-4-12(14,2)11(13)15/h9-10H,3-8H2,1-2H3,(H2,13,15)
InChIKeyYRUSSEMSLXHFLQ-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.37
Rot. Bonds3

About 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide

2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide (PubChem CID 123486269) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide
PubChem CID123486269
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide
SMILESCC1CC(CN2CCCC2(C)C(N)=O)C1
InChIInChI=1S/C12H22N2O/c1-9-6-10(7-9)8-14-5-3-4-12(14,2)11(13)15/h9-10H,3-8H2,1-2H3,(H2,13,15)
InChIKeyYRUSSEMSLXHFLQ-UHFFFAOYSA-N
XLogP1.37
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide (CID 123486269) is 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide is CC1CC(CN2CCCC2(C)C(N)=O)C1.
What is the InChIKey of 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is YRUSSEMSLXHFLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9-6-10(7-9)8-14-5-3-4-12(14,2)11(13)15/h9-10H,3-8H2,1-2H3,(H2,13,15).
What are the key properties of 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide?
2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 210.32 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 123486269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).