1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea

C20H24N2O2 — CID 113215661

IUPAC1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea
SMILESCOc1ccc(C2(NC(=O)Nc3ccc(C(C)C)cc3)CC2)cc1
InChIInChI=1S/C20H24N2O2/c1-14(2)15-4-8-17(9-5-15)21-19(23)22-20(12-13-20)16-6-10-18(24-3)11-7-16/h4-11,14H,12-13H2,1-3H3,(H2,21,22,23)
InChIKeyRSCLCBTWHDMFKP-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.63
Rot. Bonds5

About 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea

1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea (PubChem CID 113215661) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea.

Molecular Properties

Compound Name1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea
PubChem CID113215661
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea
SMILESCOc1ccc(C2(NC(=O)Nc3ccc(C(C)C)cc3)CC2)cc1
InChIInChI=1S/C20H24N2O2/c1-14(2)15-4-8-17(9-5-15)21-19(23)22-20(12-13-20)16-6-10-18(24-3)11-7-16/h4-11,14H,12-13H2,1-3H3,(H2,21,22,23)
InChIKeyRSCLCBTWHDMFKP-UHFFFAOYSA-N
XLogP4.63
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-acetylphenyl)-3-[1-(4-methoxyphenyl)cyclopropyl]urea
CID 113215697
1-(1,3-benzodioxol-5-yl)-3-[1-(4-methoxyphenyl)cyclopropyl]urea
CID 113215721
1-(3-fluorophenyl)-3-[1-(4-methoxyphenyl)cyclopropyl]urea
CID 113215715
1-methoxy-3-(4-propan-2-ylphenyl)urea
CID 134178123
1-(3-acetylphenyl)-3-[1-(4-methoxyphenyl)cyclopentyl]urea
CID 52858727
1-[2-(4-methoxyphenoxy)ethyl]-3-(4-propan-2-ylphenyl)urea
CID 108990560
1-(4-methoxyphenyl)-3-[2-(4-propan-2-ylphenoxy)ethyl]urea
CID 112972614
1,3-bis(4-methoxyphenyl)urea
CID 139045428
1-(4-phenoxyphenyl)-3-(1-phenylcyclopropyl)urea
CID 113215141
2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 2951611
N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-N'-(4-propan-2-ylphenyl)oxamide
CID 27452245
N-(4-methoxyphenyl)-5-(4-propan-2-ylanilino)pyridine-2-carboxamide
CID 109198703

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea?
The IUPAC name of 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea (CID 113215661) is 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea.
What is the SMILES notation for 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea?
The canonical SMILES for 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea is COc1ccc(C2(NC(=O)Nc3ccc(C(C)C)cc3)CC2)cc1.
What is the InChIKey of 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea?
The InChIKey is RSCLCBTWHDMFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-14(2)15-4-8-17(9-5-15)21-19(23)22-20(12-13-20)16-6-10-18(24-3)11-7-16/h4-11,14H,12-13H2,1-3H3,(H2,21,22,23).
What are the key properties of 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea?
1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea has a molecular weight of 324.42 g/mol, XLogP of 4.63, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea is sourced from PubChem (CID 113215661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).