1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea

C24H24N2O2 — CID 113215329

IUPAC1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea
SMILESCc1ccc(C2(NC(=O)Nc3ccc(OCc4ccccc4)cc3)CC2)cc1
InChIInChI=1S/C24H24N2O2/c1-18-7-9-20(10-8-18)24(15-16-24)26-23(27)25-21-11-13-22(14-12-21)28-17-19-5-3-2-4-6-19/h2-14H,15-17H2,1H3,(H2,25,26,27)
InChIKeyNNMZMHOOSWHGRS-UHFFFAOYSA-N
MW372.47 g/mol
LogP5.38
Rot. Bonds6

About 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea

1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea (PubChem CID 113215329) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea.

Molecular Properties

Compound Name1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea
PubChem CID113215329
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea
SMILESCc1ccc(C2(NC(=O)Nc3ccc(OCc4ccccc4)cc3)CC2)cc1
InChIInChI=1S/C24H24N2O2/c1-18-7-9-20(10-8-18)24(15-16-24)26-23(27)25-21-11-13-22(14-12-21)28-17-19-5-3-2-4-6-19/h2-14H,15-17H2,1H3,(H2,25,26,27)
InChIKeyNNMZMHOOSWHGRS-UHFFFAOYSA-N
XLogP5.38
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 55.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-phenylcyclopropyl)-3-(4-phenylmethoxyphenyl)urea
CID 113215142
4-(4-methylphenyl)-N-(4-phenylmethoxyphenyl)oxane-4-carboxamide
CID 100681565
1-(4-phenoxyphenyl)-3-(1-phenylcyclopropyl)urea
CID 113215141
3-(4-methylphenoxy)-N-(4-phenylmethoxyphenyl)propanamide
CID 7963977
1-(4-methoxyphenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
CID 113198528
1-[[1-(4-fluorophenyl)cyclopropyl]methyl]-3-(4-phenylmethoxyphenyl)urea
CID 113214398
1-(4-phenylmethoxyphenyl)-3-propan-2-ylurea
CID 110755142
1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
CID 2525284
[4-[4-[4-[(4-methylphenoxy)methyl]benzoyl]anilino]phenyl]-phenylmethanone
CID 58819189
1-[1-(4-methylphenyl)cyclopropyl]-3-(2-phenoxyphenyl)urea
CID 113215342
2-chloro-N-[[4-[(4-methylphenyl)methoxy]phenyl]carbamoyl]benzamide
CID 20524462
(4-methylphenyl)-(4-phenylmethoxyphenyl)methanone
CID 58133168

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea?
The IUPAC name of 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea (CID 113215329) is 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea.
What is the SMILES notation for 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea?
The canonical SMILES for 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea is Cc1ccc(C2(NC(=O)Nc3ccc(OCc4ccccc4)cc3)CC2)cc1.
What is the InChIKey of 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea?
The InChIKey is NNMZMHOOSWHGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-18-7-9-20(10-8-18)24(15-16-24)26-23(27)25-21-11-13-22(14-12-21)28-17-19-5-3-2-4-6-19/h2-14H,15-17H2,1H3,(H2,25,26,27).
What are the key properties of 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea?
1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea has a molecular weight of 372.47 g/mol, XLogP of 5.38, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methylphenyl)cyclopropyl]-3-(4-phenylmethoxyphenyl)urea is sourced from PubChem (CID 113215329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).