1-ethyl-3-(3-hydroxycyclohexyl)urea

C9H18N2O2 — CID 103618902

IUPAC1-ethyl-3-(3-hydroxycyclohexyl)urea
SMILESCCNC(=O)NC1CCCC(O)C1
InChIInChI=1S/C9H18N2O2/c1-2-10-9(13)11-7-4-3-5-8(12)6-7/h7-8,12H,2-6H2,1H3,(H2,10,11,13)
InChIKeyMHFVSILGRYLRLH-UHFFFAOYSA-N
MW186.25 g/mol
LogP0.61
Rot. Bonds2

About 1-ethyl-3-(3-hydroxycyclohexyl)urea

1-ethyl-3-(3-hydroxycyclohexyl)urea (PubChem CID 103618902) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 1-ethyl-3-(3-hydroxycyclohexyl)urea.

Molecular Properties

Compound Name1-ethyl-3-(3-hydroxycyclohexyl)urea
PubChem CID103618902
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name1-ethyl-3-(3-hydroxycyclohexyl)urea
SMILESCCNC(=O)NC1CCCC(O)C1
InChIInChI=1S/C9H18N2O2/c1-2-10-9(13)11-7-4-3-5-8(12)6-7/h7-8,12H,2-6H2,1H3,(H2,10,11,13)
InChIKeyMHFVSILGRYLRLH-UHFFFAOYSA-N
XLogP0.61
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-3-ethylurea;ethane
CID 145358709
N-[(1R,3S)-3-hydroxycyclohexyl]acetamide
CID 121286290
N-[(1R,3R)-3-hydroxycyclohexyl]acetamide
CID 130005028
2-(cyclobutylcarbamoylamino)-N-ethylacetamide
CID 115617813
cis-(1R,3S)-3-(ethylcarbamoylamino)cyclopentane-1-carboxylic acid
CID 106321445
methyl N-(3-hydroxycyclohexyl)carbamate
CID 103626697
1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea
CID 71786227
1-ethyl-3-[(1R,3R)-3-(2-methylsulfanylpropyl)cyclohexyl]urea
CID 167076650
1-[(4-chlorophenyl)methyl]-3-[(1S,3R)-3-hydroxycyclohexyl]urea
CID 95983968
2-ethoxy-N-[(1S,3R)-3-hydroxycyclohexyl]acetamide
CID 95358222
N-(3-hydroxycyclohexyl)-2-methylsulfanylacetamide
CID 131160438
1-(3-hydroxycyclohexyl)-3-[2-(4-methoxyphenyl)ethyl]urea
CID 71786236

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(3-hydroxycyclohexyl)urea?
The IUPAC name of 1-ethyl-3-(3-hydroxycyclohexyl)urea (CID 103618902) is 1-ethyl-3-(3-hydroxycyclohexyl)urea.
What is the SMILES notation for 1-ethyl-3-(3-hydroxycyclohexyl)urea?
The canonical SMILES for 1-ethyl-3-(3-hydroxycyclohexyl)urea is CCNC(=O)NC1CCCC(O)C1.
What is the InChIKey of 1-ethyl-3-(3-hydroxycyclohexyl)urea?
The InChIKey is MHFVSILGRYLRLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-2-10-9(13)11-7-4-3-5-8(12)6-7/h7-8,12H,2-6H2,1H3,(H2,10,11,13).
What are the key properties of 1-ethyl-3-(3-hydroxycyclohexyl)urea?
1-ethyl-3-(3-hydroxycyclohexyl)urea has a molecular weight of 186.25 g/mol, XLogP of 0.61, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(3-hydroxycyclohexyl)urea is sourced from PubChem (CID 103618902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).