1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea

C16H24N2O3 — CID 110902703

IUPAC1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea
SMILESCCOCc1ccccc1NC(=O)NC1CCC(O)CC1
InChIInChI=1S/C16H24N2O3/c1-2-21-11-12-5-3-4-6-15(12)18-16(20)17-13-7-9-14(19)10-8-13/h3-6,13-14,19H,2,7-11H2,1H3,(H2,17,18,20)
InChIKeyYOGWTHMWDZKURM-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.65
Rot. Bonds5

About 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea

1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea (PubChem CID 110902703) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea.

Molecular Properties

Compound Name1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea
PubChem CID110902703
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea
SMILESCCOCc1ccccc1NC(=O)NC1CCC(O)CC1
InChIInChI=1S/C16H24N2O3/c1-2-21-11-12-5-3-4-6-15(12)18-16(20)17-13-7-9-14(19)10-8-13/h3-6,13-14,19H,2,7-11H2,1H3,(H2,17,18,20)
InChIKeyYOGWTHMWDZKURM-UHFFFAOYSA-N
XLogP2.65
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-hydroxycyclohexyl)-3-[2-(phenoxymethyl)phenyl]urea
CID 60543205
trans-methyl (1S,2S)-2-[[2-(ethoxymethyl)phenyl]carbamoylamino]cyclopentane-1-carboxylate
CID 96536767
1-(4-hydroxycyclohexyl)-3-(2-propoxyphenyl)urea
CID 110890850
1-cyclopropyl-3-[2-(hydroxymethyl)phenyl]urea
CID 62699685
1-(3-chloro-2-ethoxyphenyl)-3-(4-hydroxycyclohexyl)urea
CID 110902856
3-[[2-(methoxymethyl)phenyl]carbamoylamino]cyclopentane-1-carboxylic acid
CID 66031233
ethyl 2-(cyclopentylcarbamoylamino)benzoate
CID 110755189
1-[2-(methoxymethyl)phenyl]-3-[(1R,3R)-3-methylcyclohexyl]urea
CID 94081538
1-[2-(ethoxymethyl)phenyl]-3-[[(3R)-oxolan-3-yl]methyl]urea
CID 94198923
N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide
CID 112686280
1-[2-(ethoxymethyl)phenyl]-3-(2-hydroxy-3,3-dimethylbutyl)urea
CID 111431488
1-[2-(ethoxymethyl)phenyl]-3-[(1-hydroxycyclobutyl)methyl]urea
CID 111437639

Frequently Asked Questions

What is the IUPAC name of 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea?
The IUPAC name of 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea (CID 110902703) is 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea.
What is the SMILES notation for 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea?
The canonical SMILES for 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea is CCOCc1ccccc1NC(=O)NC1CCC(O)CC1.
What is the InChIKey of 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea?
The InChIKey is YOGWTHMWDZKURM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-2-21-11-12-5-3-4-6-15(12)18-16(20)17-13-7-9-14(19)10-8-13/h3-6,13-14,19H,2,7-11H2,1H3,(H2,17,18,20).
What are the key properties of 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea?
1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea has a molecular weight of 292.38 g/mol, XLogP of 2.65, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(ethoxymethyl)phenyl]-3-(4-hydroxycyclohexyl)urea is sourced from PubChem (CID 110902703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).