1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea

C12H21N3O2 — CID 136524316

IUPAC1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea
SMILESCC(CN1CCCC1=O)NC(=O)NC1CCC1
InChIInChI=1S/C12H21N3O2/c1-9(8-15-7-3-6-11(15)16)13-12(17)14-10-4-2-5-10/h9-10H,2-8H2,1H3,(H2,13,14,17)
InChIKeyHWUHNBPSUHHWJX-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.85
Rot. Bonds4

About 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea

1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea (PubChem CID 136524316) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea.

Molecular Properties

Compound Name1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea
PubChem CID136524316
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea
SMILESCC(CN1CCCC1=O)NC(=O)NC1CCC1
InChIInChI=1S/C12H21N3O2/c1-9(8-15-7-3-6-11(15)16)13-12(17)14-10-4-2-5-10/h9-10H,2-8H2,1H3,(H2,13,14,17)
InChIKeyHWUHNBPSUHHWJX-UHFFFAOYSA-N
XLogP0.85
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide
CID 54863219
1-[1-(2-methoxyphenyl)pyrrolidin-3-yl]-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea
CID 136514128
3-amino-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]cyclohexane-1-carboxamide;hydrochloride
CID 119740525
N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2-carboxamide
CID 54863360
4-(aminomethyl)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]cyclohexane-1-carboxamide
CID 79526812
3-amino-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119740521
1-cyclopentyl-3-(1-piperidin-1-ylpropan-2-yl)urea
CID 113222806
tert-butyl N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]carbamate
CID 63789574
2-(4-aminopiperidin-1-yl)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide
CID 79328385
(2R)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]piperidine-2-carboxamide
CID 113266351
4-methoxy-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]piperidine-1-carboxamide
CID 47328029
1-cyclopentyl-3-[(2S)-1-fluoropropan-2-yl]urea
CID 127009415

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea?
The IUPAC name of 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea (CID 136524316) is 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea.
What is the SMILES notation for 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea?
The canonical SMILES for 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea is CC(CN1CCCC1=O)NC(=O)NC1CCC1.
What is the InChIKey of 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea?
The InChIKey is HWUHNBPSUHHWJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-9(8-15-7-3-6-11(15)16)13-12(17)14-10-4-2-5-10/h9-10H,2-8H2,1H3,(H2,13,14,17).
What are the key properties of 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea?
1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea has a molecular weight of 239.32 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea is sourced from PubChem (CID 136524316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).