1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea

C20H18N2O2 — CID 108904029

IUPAC1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea
SMILESCOc1ccccc1/C=C/NC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C20H18N2O2/c1-24-19-12-5-3-8-16(19)13-14-21-20(23)22-18-11-6-9-15-7-2-4-10-17(15)18/h2-14H,1H3,(H2,21,22,23)/b14-13+
InChIKeyUDPNRSGGSZRXMH-BUHFOSPRSA-N
MW318.38 g/mol
LogP4.64
Rot. Bonds4

About 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea

1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea (PubChem CID 108904029) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea.

Molecular Properties

Compound Name1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea
PubChem CID108904029
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea
SMILESCOc1ccccc1/C=C/NC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C20H18N2O2/c1-24-19-12-5-3-8-16(19)13-14-21-20(23)22-18-11-6-9-15-7-2-4-10-17(15)18/h2-14H,1H3,(H2,21,22,23)/b14-13+
InChIKeyUDPNRSGGSZRXMH-BUHFOSPRSA-N
XLogP4.64
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethoxyphenyl)-3-[(E)-2-(2-methoxyphenyl)ethenyl]urea
CID 108904070
1-(2-ethyl-6-methylphenyl)-3-[(E)-2-(2-methoxyphenyl)ethenyl]urea
CID 108903908
1-(2,4-dichlorophenyl)-3-[(E)-2-(2-methoxyphenyl)ethenyl]urea
CID 108903849
2-[4-[[(E)-2-(2-methoxyphenyl)ethenyl]carbamoylamino]phenyl]acetic acid
CID 108903974
1-(2-methoxyphenyl)-3-[(E)-2-phenylethenyl]urea
CID 108903091
1-[(E)-3,3-dimethylbut-1-enyl]-3-naphthalen-1-ylurea
CID 108911459
1-(2-methoxy-4-nitrophenyl)-3-[(E)-2-(2-methoxyphenyl)ethenyl]urea
CID 108903913
1-[2-(2-fluorophenyl)ethyl]-3-[(E)-2-(2-methoxyphenyl)ethenyl]urea
CID 108904152
1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-(3-nitrophenyl)urea
CID 108903915
1,1-diethyl-3-[(E)-2-(2-methoxyphenyl)ethenyl]urea
CID 108904010
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea?
The IUPAC name of 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea (CID 108904029) is 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea.
What is the SMILES notation for 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea?
The canonical SMILES for 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea is COc1ccccc1/C=C/NC(=O)Nc1cccc2ccccc12.
What is the InChIKey of 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea?
The InChIKey is UDPNRSGGSZRXMH-BUHFOSPRSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-24-19-12-5-3-8-16(19)13-14-21-20(23)22-18-11-6-9-15-7-2-4-10-17(15)18/h2-14H,1H3,(H2,21,22,23)/b14-13+.
What are the key properties of 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea?
1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea has a molecular weight of 318.38 g/mol, XLogP of 4.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-2-(2-methoxyphenyl)ethenyl]-3-naphthalen-1-ylurea is sourced from PubChem (CID 108904029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).