1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea

C13H26N2O2 — CID 150984877

IUPAC1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea
SMILESCCNC(=O)N(CCO)CCC1CCCCC1
InChIInChI=1S/C13H26N2O2/c1-2-14-13(17)15(10-11-16)9-8-12-6-4-3-5-7-12/h12,16H,2-11H2,1H3,(H,14,17)
InChIKeyLQWHLIXLCLVGNW-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.98
Rot. Bonds6

About 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea

1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea (PubChem CID 150984877) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea.

Molecular Properties

Compound Name1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea
PubChem CID150984877
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea
SMILESCCNC(=O)N(CCO)CCC1CCCCC1
InChIInChI=1S/C13H26N2O2/c1-2-14-13(17)15(10-11-16)9-8-12-6-4-3-5-7-12/h12,16H,2-11H2,1H3,(H,14,17)
InChIKeyLQWHLIXLCLVGNW-UHFFFAOYSA-N
XLogP1.98
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-cyclohexylethyl)-1-(2-hydroxyethyl)-3-[2-[(2S)-1-methylpyrrolidin-2-yl]ethyl]urea
CID 70023388
3-(3-cyclopentylpropyl)-1-ethyl-1-(2-hydroxyethyl)urea
CID 110896342
1-(2-cyclohexylethyl)-1-(2-hydroxyethyl)-3-(3-piperidin-1-ylpropyl)urea
CID 15541416
1-(2-cyclohexylethyl)-1-(2-hydroxyethyl)-3-[1-(4-methylpiperazine-1-carbonyl)cyclopentyl]urea
CID 22723040
1-(2-cyclopentylethyl)-1,3-dimethylurea
CID 115169542
3-cyclohexyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 103857392
3-cyclopentyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)propanamide
CID 113339851
3-(2-cyclohexylethylamino)-N-ethylpropanamide
CID 62324401
1-(2-cyclohexylethyl)-1-(3-cyclohexylpropyl)-3-(3-pyridin-4-ylpropyl)urea
CID 46911012
(2S)-4-[[3-acetylsulfanylpropyl(2-cyclohexylethyl)carbamoyl]amino]-2,3,3-trimethylbutanoic acid
CID 174423360
3-[(E)-2-cyclohexylethenyl]-1-ethyl-1-(2-hydroxyethyl)urea
CID 108912176
3-(cyclooctylmethyl)-1-(cyclopropylmethyl)-1-ethylurea
CID 86940440

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea?
The IUPAC name of 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea (CID 150984877) is 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea.
What is the SMILES notation for 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea?
The canonical SMILES for 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea is CCNC(=O)N(CCO)CCC1CCCCC1.
What is the InChIKey of 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea?
The InChIKey is LQWHLIXLCLVGNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-2-14-13(17)15(10-11-16)9-8-12-6-4-3-5-7-12/h12,16H,2-11H2,1H3,(H,14,17).
What are the key properties of 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea?
1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea has a molecular weight of 242.36 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylethyl)-3-ethyl-1-(2-hydroxyethyl)urea is sourced from PubChem (CID 150984877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).