1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea

C18H26N2O2 — CID 122132319

IUPAC1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea
SMILESO=C(NCCC1Cc2ccccc2C1)NC1CCC(O)CC1
InChIInChI=1S/C18H26N2O2/c21-17-7-5-16(6-8-17)20-18(22)19-10-9-13-11-14-3-1-2-4-15(14)12-13/h1-4,13,16-17,21H,5-12H2,(H2,19,20,22)
InChIKeyGAFUQMHGYXDBGN-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.39
Rot. Bonds4

About 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea

1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea (PubChem CID 122132319) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea.

Molecular Properties

Compound Name1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea
PubChem CID122132319
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea
SMILESO=C(NCCC1Cc2ccccc2C1)NC1CCC(O)CC1
InChIInChI=1S/C18H26N2O2/c21-17-7-5-16(6-8-17)20-18(22)19-10-9-13-11-14-3-1-2-4-15(14)12-13/h1-4,13,16-17,21H,5-12H2,(H2,19,20,22)
InChIKeyGAFUQMHGYXDBGN-UHFFFAOYSA-N
XLogP2.39
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-Hydroxycyclohexyl)-3-(4-phenylbutyl)urea
CID 154665770
1-(4-Hydroxy-2-methylcyclohexyl)-3-(4-phenylbutyl)urea
CID 154665781
1-[2-(2-Fluorophenyl)ethyl]-3-(4-hydroxycyclohexyl)urea
CID 45875839
1-(5-Hydroxy-4,4-dimethylpentyl)-3-(2-methyl-1,3-dihydroinden-2-yl)urea
CID 84593477
N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-hydroxypiperidine-1-carboxamide
CID 118740678
4-[(2,3-dihydro-1H-inden-2-yl)amino]cyclohexan-1-ol
CID 30983794
1-(2-Cyclohexyl-2-hydroxyethyl)-3-(3-phenylpropyl)urea
CID 56764370
1-(1,1a,6,6a-Tetrahydrocyclopropa[a]inden-1-yl)-3-[2-(oxan-2-yl)ethyl]urea
CID 75500372
N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(2-hydroxypropyl)morpholine-4-carboxamide
CID 75509306
3-(2,3-dihydro-1H-inden-1-yl)-1-[(2-hydroxycyclohexyl)methyl]-1-methylurea
CID 75518095
4-(4-fluorobenzyl)-N-(trans-4-hydroxycyclohexyl)piperidine-1-carboxamide
CID 119069495
4-[2-(2,4-difluorophenyl)ethyl]-N-(4-hydroxycyclohexyl)piperidine-1-carboxamide
CID 132972230

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea?
The IUPAC name of 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea (CID 122132319) is 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea.
What is the SMILES notation for 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea?
The canonical SMILES for 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea is O=C(NCCC1Cc2ccccc2C1)NC1CCC(O)CC1.
What is the InChIKey of 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea?
The InChIKey is GAFUQMHGYXDBGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c21-17-7-5-16(6-8-17)20-18(22)19-10-9-13-11-14-3-1-2-4-15(14)12-13/h1-4,13,16-17,21H,5-12H2,(H2,19,20,22).
What are the key properties of 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea?
1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea has a molecular weight of 302.42 g/mol, XLogP of 2.39, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea is sourced from PubChem (CID 122132319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).