2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide

C14H26N4O3 — CID 167769215

IUPAC2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)CNC(=O)N(C)CC(=O)N1CCCC1
InChIInChI=1S/C14H26N4O3/c1-11(2)8-15-12(19)9-16-14(21)17(3)10-13(20)18-6-4-5-7-18/h11H,4-10H2,1-3H3,(H,15,19)(H,16,21)
InChIKeyPBKGSWLVUXVYKI-UHFFFAOYSA-N
MW298.39 g/mol
LogP0.02
Rot. Bonds6

About 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide

2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide (PubChem CID 167769215) has the molecular formula C14H26N4O3 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide
PubChem CID167769215
Molecular FormulaC14H26N4O3
Molecular Weight298.39 g/mol
Exact Mass298.20
IUPAC Name2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)CNC(=O)N(C)CC(=O)N1CCCC1
InChIInChI=1S/C14H26N4O3/c1-11(2)8-15-12(19)9-16-14(21)17(3)10-13(20)18-6-4-5-7-18/h11H,4-10H2,1-3H3,(H,15,19)(H,16,21)
InChIKeyPBKGSWLVUXVYKI-UHFFFAOYSA-N
XLogP0.02
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]propanoic acid
CID 78971244
3-butyl-1-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)urea
CID 115574208
4-methyl-2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]pentanoic acid
CID 61439871
3-tert-butyl-1-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)urea
CID 115574206
4-[methyl-[(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]butanoic acid
CID 113406371
1-(2-methylpropyl)-3-(2-oxo-2-pyrrolidin-1-ylethyl)thiourea
CID 115576760
2-[acetyl(methyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 56811944
2-methyl-2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]butanoic acid
CID 79801349
2-(butan-2-ylamino)-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 54872948
2-amino-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide
CID 60963477
N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]morpholine-4-carboxamide
CID 116657762
(2S)-2-amino-N,4-dimethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)pentanamide
CID 61164738

Frequently Asked Questions

What is the IUPAC name of 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide (CID 167769215) is 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide is CC(C)CNC(=O)CNC(=O)N(C)CC(=O)N1CCCC1.
What is the InChIKey of 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide?
The InChIKey is PBKGSWLVUXVYKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O3/c1-11(2)8-15-12(19)9-16-14(21)17(3)10-13(20)18-6-4-5-7-18/h11H,4-10H2,1-3H3,(H,15,19)(H,16,21).
What are the key properties of 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide?
2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide has a molecular weight of 298.39 g/mol, XLogP of 0.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]amino]-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 167769215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).