3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea

C13H24N2O2 — CID 115642256

IUPAC3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea
SMILESCOCCN(C(=O)NC1CCC1)C(C)C1CC1
InChIInChI=1S/C13H24N2O2/c1-10(11-6-7-11)15(8-9-17-2)13(16)14-12-4-3-5-12/h10-12H,3-9H2,1-2H3,(H,14,16)
InChIKeyRABLBZHOZHWBKV-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.00
Rot. Bonds6

About 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea

3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea (PubChem CID 115642256) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea.

Molecular Properties

Compound Name3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea
PubChem CID115642256
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea
SMILESCOCCN(C(=O)NC1CCC1)C(C)C1CC1
InChIInChI=1S/C13H24N2O2/c1-10(11-6-7-11)15(8-9-17-2)13(16)14-12-4-3-5-12/h10-12H,3-9H2,1-2H3,(H,14,16)
InChIKeyRABLBZHOZHWBKV-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-tert-butyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea
CID 113256723
2-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propanamide
CID 60948418
N-(1-cyclopropylethyl)-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide
CID 103429770
3-[1-cyclopropylethyl(2-methoxyethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63784695
methyl 2-[cyclobutylcarbamoyl(propan-2-yl)amino]acetate
CID 116655081
2-[cyclobutylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79269687
N-(1-cyclopropylethyl)-2-(ethylamino)-N-(2-methoxyethyl)-2-methylpropanamide
CID 62834379
(2S)-2-[[1-cyclopropylethyl(2-methoxyethyl)carbamoyl]amino]hexanoic acid
CID 107145828
1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 54872120
2-[[1-cyclopropylethyl(2-methoxyethyl)carbamoyl]-methylamino]propanoic acid
CID 62637212
cis-(1S,2R)-2-[1-cyclopropylethyl(2-methoxyethyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 114091974
5-[1-cyclopropylethyl(2-methoxyethyl)amino]-5-oxopentanoic acid
CID 54875337

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea?
The IUPAC name of 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea (CID 115642256) is 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea.
What is the SMILES notation for 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea?
The canonical SMILES for 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea is COCCN(C(=O)NC1CCC1)C(C)C1CC1.
What is the InChIKey of 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea?
The InChIKey is RABLBZHOZHWBKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10(11-6-7-11)15(8-9-17-2)13(16)14-12-4-3-5-12/h10-12H,3-9H2,1-2H3,(H,14,16).
What are the key properties of 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea?
3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea has a molecular weight of 240.35 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)urea is sourced from PubChem (CID 115642256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).