3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide

C10H18N2O2 — CID 110736478

IUPAC3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
SMILESCC(C)CC(=O)NC1CC(=O)N(C)C1
InChIInChI=1S/C10H18N2O2/c1-7(2)4-9(13)11-8-5-10(14)12(3)6-8/h7-8H,4-6H2,1-3H3,(H,11,13)
InChIKeySJFBXRCMGPGCRL-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.38
Rot. Bonds3

About 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide

3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide (PubChem CID 110736478) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide.

Molecular Properties

Compound Name3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
PubChem CID110736478
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
SMILESCC(C)CC(=O)NC1CC(=O)N(C)C1
InChIInChI=1S/C10H18N2O2/c1-7(2)4-9(13)11-8-5-10(14)12(3)6-8/h7-8H,4-6H2,1-3H3,(H,11,13)
InChIKeySJFBXRCMGPGCRL-UHFFFAOYSA-N
XLogP0.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopropyl-5-oxopyrrolidin-3-yl)-3-methylbutanamide
CID 110719693
3-chloro-N-(1-methyl-5-oxopyrrolidin-3-yl)propanamide
CID 130585425
N-(1-methyl-5-oxopyrrolidin-3-yl)-3-sulfanylpropanamide
CID 126983919
(3S)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-3-[4-(trifluoromethyl)phenyl]butanamide
CID 95289611
2-ethyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
CID 60616692
1-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-3-propan-2-ylurea
CID 95969340
1-(1-methyl-5-oxopyrrolidin-3-yl)-3-propan-2-ylurea
CID 71789164
3-methyl-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)butanamide
CID 58708342
N-(1-methyl-5-oxopyrrolidin-3-yl)-3-oxo-3-phenylpropanamide
CID 110473177
N-[(3R)-1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]-3-methylbutanamide
CID 7255518
2-amino-3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)pentanamide
CID 119758230
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methyl-5-oxopyrrolidin-3-yl)acetamide
CID 71789161

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide?
The IUPAC name of 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide (CID 110736478) is 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide.
What is the SMILES notation for 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide?
The canonical SMILES for 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide is CC(C)CC(=O)NC1CC(=O)N(C)C1.
What is the InChIKey of 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide?
The InChIKey is SJFBXRCMGPGCRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-7(2)4-9(13)11-8-5-10(14)12(3)6-8/h7-8H,4-6H2,1-3H3,(H,11,13).
What are the key properties of 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide?
3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide has a molecular weight of 198.27 g/mol, XLogP of 0.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide is sourced from PubChem (CID 110736478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).