1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea

C11H22N2O2 — CID 103743870

IUPAC1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea
SMILESCCN(C)C(=O)NC1CC(OC)C1(C)C
InChIInChI=1S/C11H22N2O2/c1-6-13(4)10(14)12-8-7-9(15-5)11(8,2)3/h8-9H,6-7H2,1-5H3,(H,12,14)
InChIKeyUIVUSGUNLMARRQ-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.46
Rot. Bonds3

About 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea

1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea (PubChem CID 103743870) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea.

Molecular Properties

Compound Name1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea
PubChem CID103743870
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea
SMILESCCN(C)C(=O)NC1CC(OC)C1(C)C
InChIInChI=1S/C11H22N2O2/c1-6-13(4)10(14)12-8-7-9(15-5)11(8,2)3/h8-9H,6-7H2,1-5H3,(H,12,14)
InChIKeyUIVUSGUNLMARRQ-UHFFFAOYSA-N
XLogP1.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-2-oxoacetic acid
CID 104768155
N-(3-methoxy-2,2-dimethylcyclobutyl)prop-2-ynamide
CID 130677750
2-chloro-N-(3-methoxy-2,2-dimethylcyclobutyl)prop-2-enamide
CID 130952253
4-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)butanamide
CID 103798000
(2R)-2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)propanamide
CID 103797993
1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)thiourea
CID 103742080
2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-methylpentanamide
CID 113267255
N-(3-methoxy-2,2-dimethylcyclobutyl)pyrrolidine-1-carboxamide
CID 103743813
4-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 114118830
3-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)butanamide;hydrochloride
CID 119817878
3-[(3-butoxy-2,2-dimethylcyclobutyl)carbamoyl-methylamino]-2-methylpropanoic acid
CID 122005126
2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide
CID 103812779

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea?
The IUPAC name of 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea (CID 103743870) is 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea.
What is the SMILES notation for 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea?
The canonical SMILES for 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea is CCN(C)C(=O)NC1CC(OC)C1(C)C.
What is the InChIKey of 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea?
The InChIKey is UIVUSGUNLMARRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-6-13(4)10(14)12-8-7-9(15-5)11(8,2)3/h8-9H,6-7H2,1-5H3,(H,12,14).
What are the key properties of 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea?
1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea has a molecular weight of 214.31 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)-1-methylurea is sourced from PubChem (CID 103743870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).