1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea

C15H26N4O3 — CID 75378759

IUPAC1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea
SMILESCc1noc(CCNC(=O)NC(C)(CO)C2CCCCC2)n1
InChIInChI=1S/C15H26N4O3/c1-11-17-13(22-19-11)8-9-16-14(21)18-15(2,10-20)12-6-4-3-5-7-12/h12,20H,3-10H2,1-2H3,(H2,16,18,21)
InChIKeyUUGFDRGLOXBXOZ-UHFFFAOYSA-N
MW310.40 g/mol
LogP1.55
Rot. Bonds6

About 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea

1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea (PubChem CID 75378759) has the molecular formula C15H26N4O3 and a molecular weight of 310.40 g/mol. Its IUPAC name is 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea.

Molecular Properties

Compound Name1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea
PubChem CID75378759
Molecular FormulaC15H26N4O3
Molecular Weight310.40 g/mol
Exact Mass310.20
IUPAC Name1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea
SMILESCc1noc(CCNC(=O)NC(C)(CO)C2CCCCC2)n1
InChIInChI=1S/C15H26N4O3/c1-11-17-13(22-19-11)8-9-16-14(21)18-15(2,10-20)12-6-4-3-5-7-12/h12,20H,3-10H2,1-2H3,(H2,16,18,21)
InChIKeyUUGFDRGLOXBXOZ-UHFFFAOYSA-N
XLogP1.55
TPSA100.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea with MolForge

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Related Compounds

1-[(4-tert-butyl-1-hydroxycyclohexyl)methyl]-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea
CID 111115226
1-[2-[(S)-tert-butylsulfinyl]ethyl]-3-[(2S)-2-cyclohexyl-1-hydroxypropan-2-yl]urea
CID 97054897
3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylcarbamoylamino]propanoic acid
CID 106420746
1-(2-cyclopropyl-1-hydroxypropan-2-yl)-3-[2-(oxan-2-yl)ethyl]urea
CID 110025019
3-chloro-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylcarbamoyl]propanamide
CID 106421413
2,2-dimethyl-4-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylcarbamoylamino]-4-oxobutanoic acid
CID 106419385
1-[[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylcarbamoylamino]methyl]cyclopentane-1-carboxylic acid
CID 106420807
1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylcarbamoyl]pyrrolidine-2-carboxylic acid
CID 113363783
2-iodo-3,3-dimethyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 89148487
4,4-difluoro-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]cyclohexane-1-carboxamide
CID 146123022
1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylcarbamoylamino]cyclopropane-1-carboxylic acid
CID 113363786
4-amino-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]cyclohexane-1-carboxamide
CID 103796117

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea?
The IUPAC name of 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea (CID 75378759) is 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea.
What is the SMILES notation for 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea?
The canonical SMILES for 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea is Cc1noc(CCNC(=O)NC(C)(CO)C2CCCCC2)n1.
What is the InChIKey of 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea?
The InChIKey is UUGFDRGLOXBXOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O3/c1-11-17-13(22-19-11)8-9-16-14(21)18-15(2,10-20)12-6-4-3-5-7-12/h12,20H,3-10H2,1-2H3,(H2,16,18,21).
What are the key properties of 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea?
1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea has a molecular weight of 310.40 g/mol, XLogP of 1.55, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea is sourced from PubChem (CID 75378759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).