3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide

C11H22N2O — CID 83619295

IUPAC3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide
SMILESCC(C)CC(=O)NCCC1CCCN1
InChIInChI=1S/C11H22N2O/c1-9(2)8-11(14)13-7-5-10-4-3-6-12-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyJAHDGCPPFLQMNK-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.29
Rot. Bonds5

About 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide

3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide (PubChem CID 83619295) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide.

Molecular Properties

Compound Name3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide
PubChem CID83619295
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide
SMILESCC(C)CC(=O)NCCC1CCCN1
InChIInChI=1S/C11H22N2O/c1-9(2)8-11(14)13-7-5-10-4-3-6-12-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyJAHDGCPPFLQMNK-UHFFFAOYSA-N
XLogP1.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methoxy-3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide
CID 114793829
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]propanamide
CID 104955188
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide
CID 104955184
3,3-dimethyl-N-(2-pyrrolidin-2-ylethyl)butanamide
CID 114793955
2-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]propanamide
CID 104955350
2-ethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]butanamide
CID 104972087
1-ethyl-3-[2-[(2R)-pyrrolidin-2-yl]ethyl]urea
CID 104972281
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]dodecanamide
CID 104971837
N-(2-pyrrolidin-2-ylethyl)octanamide
CID 114793852
1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide
CID 114793919
3,3-dimethyl-N-(2-piperidin-2-ylethyl)butanamide
CID 24697478
N-(2-pyrrolidin-2-ylethyl)pent-4-enamide
CID 114793761

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide?
The IUPAC name of 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide (CID 83619295) is 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide.
What is the SMILES notation for 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide?
The canonical SMILES for 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide is CC(C)CC(=O)NCCC1CCCN1.
What is the InChIKey of 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide?
The InChIKey is JAHDGCPPFLQMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(2)8-11(14)13-7-5-10-4-3-6-12-10/h9-10,12H,3-8H2,1-2H3,(H,13,14).
What are the key properties of 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide?
3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide has a molecular weight of 198.31 g/mol, XLogP of 1.29, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide is sourced from PubChem (CID 83619295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).