1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea

C11H22N2O2 — CID 47133656

IUPAC1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea
SMILESCOCCNC(=O)NC1CCCCC1C
InChIInChI=1S/C11H22N2O2/c1-9-5-3-4-6-10(9)13-11(14)12-7-8-15-2/h9-10H,3-8H2,1-2H3,(H2,12,13,14)
InChIKeyDWAMERSEXIGJGD-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.51
Rot. Bonds4

About 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea

1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea (PubChem CID 47133656) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea.

Molecular Properties

Compound Name1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea
PubChem CID47133656
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea
SMILESCOCCNC(=O)NC1CCCCC1C
InChIInChI=1S/C11H22N2O2/c1-9-5-3-4-6-10(9)13-11(14)12-7-8-15-2/h9-10H,3-8H2,1-2H3,(H2,12,13,14)
InChIKeyDWAMERSEXIGJGD-UHFFFAOYSA-N
XLogP1.51
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-methylcycloheptyl)-3-propylurea
CID 115660989
N-(2-methoxyethyl)-2-[(2-methylcyclohexyl)amino]acetamide
CID 60646854
1-(cyclopentylmethyl)-3-(2-methylcyclohexyl)urea
CID 108902589
1-(2-methylcyclopentyl)-3-[2-(2-methylprop-2-enoxy)ethyl]urea
CID 71917531
1-[(1S,2S)-2-methylcyclopentyl]-3-[2-(2-methylprop-2-enoxy)ethyl]urea
CID 97092212
1-ethyl-3-(2-methylcyclohexyl)urea
CID 112682943
2-(3-methoxypropylcarbamoylamino)cyclohexane-1-carboxylic acid
CID 64817862
1-(3-hydroxypropyl)-3-(2-methylcyclopentyl)urea
CID 111104441
2-hydroxy-4-[(2-methylcyclohexyl)carbamoylamino]butanoic acid
CID 114007129
2-methyl-4-[(2-methylcycloheptyl)carbamoylamino]butanoic acid
CID 80541155
1-(5-hydroxy-4,4-dimethylpentyl)-3-(2-methylcyclohexyl)urea
CID 111503873
methyl N-(2-methylcyclohexyl)carbamate
CID 58423091

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea?
The IUPAC name of 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea (CID 47133656) is 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea.
What is the SMILES notation for 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea?
The canonical SMILES for 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea is COCCNC(=O)NC1CCCCC1C.
What is the InChIKey of 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea?
The InChIKey is DWAMERSEXIGJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9-5-3-4-6-10(9)13-11(14)12-7-8-15-2/h9-10H,3-8H2,1-2H3,(H2,12,13,14).
What are the key properties of 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea?
1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea has a molecular weight of 214.31 g/mol, XLogP of 1.51, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea is sourced from PubChem (CID 47133656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).