1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea

C26H24N2O2 — CID 42698041

IUPAC1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea
SMILESC/C(=C/c1ccccc1)CN(Cc1ccco1)C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C26H24N2O2/c1-20(17-21-9-3-2-4-10-21)18-28(19-23-13-8-16-30-23)26(29)27-25-15-7-12-22-11-5-6-14-24(22)25/h2-17H,18-19H2,1H3,(H,27,29)/b20-17-
InChIKeyHJCXIVWFYRCRJF-JZJYNLBNSA-N
MW396.49 g/mol
LogP6.57
Rot. Bonds6

About 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea

1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea (PubChem CID 42698041) has the molecular formula C26H24N2O2 and a molecular weight of 396.49 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea
PubChem CID42698041
Molecular FormulaC26H24N2O2
Molecular Weight396.49 g/mol
Exact Mass396.18
IUPAC Name1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea
SMILESC/C(=C/c1ccccc1)CN(Cc1ccco1)C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C26H24N2O2/c1-20(17-21-9-3-2-4-10-21)18-28(19-23-13-8-16-30-23)26(29)27-25-15-7-12-22-11-5-6-14-24(22)25/h2-17H,18-19H2,1H3,(H,27,29)/b20-17-
InChIKeyHJCXIVWFYRCRJF-JZJYNLBNSA-N
XLogP6.57
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.49
LogP ≤ 56.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(furan-2-ylmethyl)-3-(2-methoxyphenyl)-1-[(E)-2-methyl-3-phenylprop-2-enyl]urea
CID 42698044
1-(furan-2-ylmethyl)-1-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]-3-naphthalen-1-ylurea
CID 42702156
N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-2-[naphthalen-1-ylcarbamoyl(propyl)amino]acetamide
CID 3601767
2-(4-chlorophenoxy)-N-(furan-2-ylmethyl)-N-[(E)-2-methyl-3-phenylprop-2-enyl]acetamide
CID 5437642
1-benzyl-1-[(E)-2-methyl-3-phenylprop-2-enyl]-3-phenylurea
CID 42697732
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(furan-2-ylmethyl)-2-[naphthalen-1-ylcarbamoyl(propan-2-yl)amino]acetamide
CID 4003325
N-benzyl-N-(furan-2-ylmethyl)-2-naphthalen-1-ylacetamide
CID 18830847
1,1-bis(2-methylpropyl)-3-naphthalen-1-ylurea
CID 19835720
1-(anthracen-9-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-(furan-2-ylmethyl)urea
CID 42697710
3-[[ethyl(furan-2-ylmethyl)carbamoyl]amino]pyridine-2-carboxylic acid
CID 104743357
2-[furan-2-ylmethyl-[(2-methylphenyl)carbamoyl]amino]-N-[(5-methylfuran-2-yl)methyl]-N-(2-phenylethyl)acetamide
CID 5110905
3-[acetyl(furan-2-ylmethyl)amino]-N-(2-phenoxyphenyl)propanamide
CID 113118157

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea?
The IUPAC name of 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea (CID 42698041) is 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea.
What is the SMILES notation for 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea?
The canonical SMILES for 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea is C/C(=C/c1ccccc1)CN(Cc1ccco1)C(=O)Nc1cccc2ccccc12.
What is the InChIKey of 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea?
The InChIKey is HJCXIVWFYRCRJF-JZJYNLBNSA-N. The full InChI is InChI=1S/C26H24N2O2/c1-20(17-21-9-3-2-4-10-21)18-28(19-23-13-8-16-30-23)26(29)27-25-15-7-12-22-11-5-6-14-24(22)25/h2-17H,18-19H2,1H3,(H,27,29)/b20-17-.
What are the key properties of 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea?
1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea has a molecular weight of 396.49 g/mol, XLogP of 6.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]-3-naphthalen-1-ylurea is sourced from PubChem (CID 42698041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).