1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea

C11H19N3O3 — CID 138049629

IUPAC1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea
SMILESCN1C[C@@H](NC(=O)NCC2(C)COC2)CC1=O
InChIInChI=1S/C11H19N3O3/c1-11(6-17-7-11)5-12-10(16)13-8-3-9(15)14(2)4-8/h8H,3-7H2,1-2H3,(H2,12,13,16)/t8-/m0/s1
InChIKeyWMLLWFRLRFULKV-QMMMGPOBSA-N
MW241.29 g/mol
LogP-0.45
Rot. Bonds3

About 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea

1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea (PubChem CID 138049629) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea.

Molecular Properties

Compound Name1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea
PubChem CID138049629
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea
SMILESCN1C[C@@H](NC(=O)NCC2(C)COC2)CC1=O
InChIInChI=1S/C11H19N3O3/c1-11(6-17-7-11)5-12-10(16)13-8-3-9(15)14(2)4-8/h8H,3-7H2,1-2H3,(H2,12,13,16)/t8-/m0/s1
InChIKeyWMLLWFRLRFULKV-QMMMGPOBSA-N
XLogP-0.45
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-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

1-cyclopropyl-3-[(3-methyloxetan-3-yl)methyl]urea
CID 115624323
1-(1-methyl-5-oxopyrrolidin-3-yl)-3-pentylurea
CID 56794755
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
1-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]-3-(2-phenylethyl)urea
CID 94796717
N-(1-methyl-5-oxopyrrolidin-3-yl)-3-sulfanylpropanamide
CID 126983919
2-ethyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
CID 60616692
1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea
CID 138009909
3-chloro-N-(1-methyl-5-oxopyrrolidin-3-yl)propanamide
CID 130585425
3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
CID 110736478
1-[[4-(difluoromethoxy)-3-fluorophenyl]methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea
CID 138010386
1-cyclopropyl-3-[(4-methyloxan-4-yl)methyl]urea
CID 103742048

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea?
The IUPAC name of 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea (CID 138049629) is 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea.
What is the SMILES notation for 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea?
The canonical SMILES for 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea is CN1C[C@@H](NC(=O)NCC2(C)COC2)CC1=O.
What is the InChIKey of 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea?
The InChIKey is WMLLWFRLRFULKV-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-11(6-17-7-11)5-12-10(16)13-8-3-9(15)14(2)4-8/h8H,3-7H2,1-2H3,(H2,12,13,16)/t8-/m0/s1.
What are the key properties of 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea?
1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea has a molecular weight of 241.29 g/mol, XLogP of -0.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea is sourced from PubChem (CID 138049629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).