1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea

C17H26N2O2 — CID 146221893

IUPAC1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea
SMILESCCCc1ccc(OC)c(NC(=O)NC2CCCCC2)c1
InChIInChI=1S/C17H26N2O2/c1-3-7-13-10-11-16(21-2)15(12-13)19-17(20)18-14-8-5-4-6-9-14/h10-12,14H,3-9H2,1-2H3,(H2,18,19,20)
InChIKeyKFZRIGDEIAGIHU-UHFFFAOYSA-N
MW290.41 g/mol
LogP4.10
Rot. Bonds5

About 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea

1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea (PubChem CID 146221893) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea.

Molecular Properties

Compound Name1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea
PubChem CID146221893
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea
SMILESCCCc1ccc(OC)c(NC(=O)NC2CCCCC2)c1
InChIInChI=1S/C17H26N2O2/c1-3-7-13-10-11-16(21-2)15(12-13)19-17(20)18-14-8-5-4-6-9-14/h10-12,14H,3-9H2,1-2H3,(H2,18,19,20)
InChIKeyKFZRIGDEIAGIHU-UHFFFAOYSA-N
XLogP4.10
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-cycloheptyl-3-(2,5-dimethoxyphenyl)urea
CID 6470715
1-(5-chloro-2-methoxyphenyl)-3-cyclododecylurea
CID 108875500
N-[3-(cyclohexylcarbamoylamino)-4-methoxyphenyl]acetamide
CID 4120812
1-cyclohexyl-3-[2-(4-ethoxy-3-methoxyphenyl)ethyl]urea
CID 108891509
N-cyclododecyl-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221706
1-cyclohexyl-3-(4-fluoro-2-methoxyphenyl)urea
CID 47202448
3-amino-N-[5-(cyclohexylcarbamoylamino)-2-methoxyphenyl]propanamide
CID 82034660
N-[3-(cyclopropylcarbamoylamino)-4-methoxyphenyl]acetamide
CID 47127639
1-cyclohexyl-3-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]urea
CID 4553215
N-cyclopentyl-4-(3,4-dimethoxyphenyl)butanamide
CID 110407029
N-cycloheptyl-2-(3,4-dimethoxyphenyl)acetamide
CID 720355
2-(2-bromo-4-propylphenoxy)-N-cycloheptylacetamide
CID 19201484

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea?
The IUPAC name of 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea (CID 146221893) is 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea.
What is the SMILES notation for 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea?
The canonical SMILES for 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea is CCCc1ccc(OC)c(NC(=O)NC2CCCCC2)c1.
What is the InChIKey of 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea?
The InChIKey is KFZRIGDEIAGIHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-7-13-10-11-16(21-2)15(12-13)19-17(20)18-14-8-5-4-6-9-14/h10-12,14H,3-9H2,1-2H3,(H2,18,19,20).
What are the key properties of 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea?
1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea has a molecular weight of 290.41 g/mol, XLogP of 4.10, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(2-methoxy-5-propylphenyl)urea is sourced from PubChem (CID 146221893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).