1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea

C22H20N2O2 — CID 23734545

IUPAC1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)NC1Cc2ccccc2C1
InChIInChI=1S/C22H20N2O2/c25-22(24-19-14-16-6-4-5-7-17(16)15-19)23-18-10-12-21(13-11-18)26-20-8-2-1-3-9-20/h1-13,19H,14-15H2,(H2,23,24,25)
InChIKeyRCYYVFYCDMOJJB-UHFFFAOYSA-N
MW344.41 g/mol
LogP4.77
Rot. Bonds4

About 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea

1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea (PubChem CID 23734545) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea
PubChem CID23734545
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC Name1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)NC1Cc2ccccc2C1
InChIInChI=1S/C22H20N2O2/c25-22(24-19-14-16-6-4-5-7-17(16)15-19)23-18-10-12-21(13-11-18)26-20-8-2-1-3-9-20/h1-13,19H,14-15H2,(H2,23,24,25)
InChIKeyRCYYVFYCDMOJJB-UHFFFAOYSA-N
XLogP4.77
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclobutyl-3-(4-phenoxyphenyl)urea
CID 23959001
1-(1-acetylpiperidin-4-yl)-3-(4-phenoxyphenyl)urea
CID 25070785
1-(3,4-dichlorophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea
CID 9350005
1-[(3S)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-3-(4-phenoxyphenyl)urea
CID 7513892
N-(4-phenoxyphenyl)-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)azetidine-1-carboxamide
CID 11993713
1-amino-3-(4-phenoxyphenyl)urea;hydrochloride
CID 19701837
1-[(3R,7R,8aS)-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-7-yl]-3-(4-phenoxyphenyl)urea
CID 154819930
1-cyclopropyl-3-[6-(4-phenoxyanilino)pyridazin-3-yl]urea
CID 113049902
(2R)-N-(4-phenoxyphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 9074346
1-(4-phenoxyphenyl)-3-(1-phenylcyclopropyl)urea
CID 113215141
4-[(3-phenoxyphenyl)carbamoylamino]cyclohexane-1-carboxylic acid
CID 122084514
4-(cyclopropylcarbamoylamino)-N-[4-(3-methylphenoxy)phenyl]benzamide
CID 55678662

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea?
The IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea (CID 23734545) is 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea is O=C(Nc1ccc(Oc2ccccc2)cc1)NC1Cc2ccccc2C1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea?
The InChIKey is RCYYVFYCDMOJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2/c25-22(24-19-14-16-6-4-5-7-17(16)15-19)23-18-10-12-21(13-11-18)26-20-8-2-1-3-9-20/h1-13,19H,14-15H2,(H2,23,24,25).
What are the key properties of 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea?
1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea has a molecular weight of 344.41 g/mol, XLogP of 4.77, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea is sourced from PubChem (CID 23734545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).