1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea

C23H24N2O3 — CID 60577038

IUPAC1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea
SMILESO=C(Nc1ccccc1-c1ccccc1)N(Cc1ccco1)CC1CCCO1
InChIInChI=1S/C23H24N2O3/c26-23(24-22-13-5-4-12-21(22)18-8-2-1-3-9-18)25(16-19-10-6-14-27-19)17-20-11-7-15-28-20/h1-6,8-10,12-14,20H,7,11,15-17H2,(H,24,26)
InChIKeyYMNMAOKSVLTELL-UHFFFAOYSA-N
MW376.46 g/mol
LogP5.16
Rot. Bonds6

About 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea

1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea (PubChem CID 60577038) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea
PubChem CID60577038
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC Name1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea
SMILESO=C(Nc1ccccc1-c1ccccc1)N(Cc1ccco1)CC1CCCO1
InChIInChI=1S/C23H24N2O3/c26-23(24-22-13-5-4-12-21(22)18-8-2-1-3-9-18)25(16-19-10-6-14-27-19)17-20-11-7-15-28-20/h1-6,8-10,12-14,20H,7,11,15-17H2,(H,24,26)
InChIKeyYMNMAOKSVLTELL-UHFFFAOYSA-N
XLogP5.16
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.46
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-2-ylmethyl)-3-(2-methoxyphenyl)-1-[[(2S)-oxolan-2-yl]methyl]urea
CID 773145
1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-[2-(trifluoromethoxy)phenyl]urea
CID 60577749
3-(3-chloro-2-fluorophenyl)-1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)urea
CID 60577089
1-(2-methoxyethyl)-1-[[(2R)-oxolan-2-yl]methyl]-3-(2-phenylphenyl)urea
CID 97454548
3-(2,5-dibromophenyl)-1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)urea
CID 60577447
3-(2,4-dichlorophenyl)-1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)urea
CID 42773317
N-benzyl-2-[(2-fluorophenyl)carbamoyl-(oxolan-2-ylmethyl)amino]-N-(furan-2-ylmethyl)acetamide
CID 5244605
3-(3-acetylphenyl)-1-(furan-2-ylmethyl)-1-[[(2R)-oxolan-2-yl]methyl]urea
CID 94652128
3-(dicyclopropylmethyl)-1-(furan-2-ylmethyl)-1-[[(2S)-oxolan-2-yl]methyl]urea
CID 94653061
N-(furan-2-ylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]cyclopropanecarboxamide
CID 772640
1-(furan-2-ylmethyl)-3-(5-methyl-1,3,4-thiadiazol-2-yl)-1-[[(2S)-oxolan-2-yl]methyl]urea
CID 94651994
N-(furan-2-ylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide
CID 29133111

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea?
The IUPAC name of 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea (CID 60577038) is 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea.
What is the SMILES notation for 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea?
The canonical SMILES for 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea is O=C(Nc1ccccc1-c1ccccc1)N(Cc1ccco1)CC1CCCO1.
What is the InChIKey of 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea?
The InChIKey is YMNMAOKSVLTELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c26-23(24-22-13-5-4-12-21(22)18-8-2-1-3-9-18)25(16-19-10-6-14-27-19)17-20-11-7-15-28-20/h1-6,8-10,12-14,20H,7,11,15-17H2,(H,24,26).
What are the key properties of 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea?
1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea has a molecular weight of 376.46 g/mol, XLogP of 5.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-1-(oxolan-2-ylmethyl)-3-(2-phenylphenyl)urea is sourced from PubChem (CID 60577038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).