1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea

C12H24N2O2 — CID 103800433

IUPAC1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea
SMILESCCN(CC)C(=O)NCC1(CCOC)CC1
InChIInChI=1S/C12H24N2O2/c1-4-14(5-2)11(15)13-10-12(6-7-12)8-9-16-3/h4-10H2,1-3H3,(H,13,15)
InChIKeyGUKCEVRSPJMGAU-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.85
Rot. Bonds7

About 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea

1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea (PubChem CID 103800433) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea.

Molecular Properties

Compound Name1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea
PubChem CID103800433
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea
SMILESCCN(CC)C(=O)NCC1(CCOC)CC1
InChIInChI=1S/C12H24N2O2/c1-4-14(5-2)11(15)13-10-12(6-7-12)8-9-16-3/h4-10H2,1-3H3,(H,13,15)
InChIKeyGUKCEVRSPJMGAU-UHFFFAOYSA-N
XLogP1.85
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-diethyl-3-[(1-ethylcyclobutyl)methyl]urea
CID 103741057
2-methoxy-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]propanamide
CID 103799994
(E)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]but-2-enamide
CID 103800053
1,1-diethyl-3-[(1-methylcyclopentyl)methyl]urea
CID 115618855
2-(tert-butylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
CID 113264722
2-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]-2-methylpropanamide
CID 119344523
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-propan-2-yloxyacetamide
CID 103800058
3-[[1-(dimethylamino)cyclopentyl]methyl]-1,1-diethylurea
CID 113223972
1-cyclobutyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea
CID 103793976
2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
CID 114112932
1-cyclopentyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea
CID 103793592
1-[(diethylcarbamoylamino)methyl]cyclopropane-1-carboxylic acid
CID 115450090

Frequently Asked Questions

What is the IUPAC name of 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea?
The IUPAC name of 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea (CID 103800433) is 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea.
What is the SMILES notation for 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea?
The canonical SMILES for 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea is CCN(CC)C(=O)NCC1(CCOC)CC1.
What is the InChIKey of 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea?
The InChIKey is GUKCEVRSPJMGAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-14(5-2)11(15)13-10-12(6-7-12)8-9-16-3/h4-10H2,1-3H3,(H,13,15).
What are the key properties of 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea?
1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea has a molecular weight of 228.34 g/mol, XLogP of 1.85, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diethyl-3-[[1-(2-methoxyethyl)cyclopropyl]methyl]urea is sourced from PubChem (CID 103800433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).