1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

C23H24N2O — CID 67473122

IUPAC1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea
SMILESC=C(C)c1cccc(C(C)(C)NC(=O)Nc2ccc3ccccc3c2)c1
InChIInChI=1S/C23H24N2O/c1-16(2)18-10-7-11-20(14-18)23(3,4)25-22(26)24-21-13-12-17-8-5-6-9-19(17)15-21/h5-15H,1H2,2-4H3,(H2,24,25,26)
InChIKeyLDDSRGGMIQLXIO-UHFFFAOYSA-N
MW344.46 g/mol
LogP5.93
Rot. Bonds4

About 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea (PubChem CID 67473122) has the molecular formula C23H24N2O and a molecular weight of 344.46 g/mol. Its IUPAC name is 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea.

Molecular Properties

Compound Name1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea
PubChem CID67473122
Molecular FormulaC23H24N2O
Molecular Weight344.46 g/mol
Exact Mass344.19
IUPAC Name1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea
SMILESC=C(C)c1cccc(C(C)(C)NC(=O)Nc2ccc3ccccc3c2)c1
InChIInChI=1S/C23H24N2O/c1-16(2)18-10-7-11-20(14-18)23(3,4)25-22(26)24-21-13-12-17-8-5-6-9-19(17)15-21/h5-15H,1H2,2-4H3,(H2,24,25,26)
InChIKeyLDDSRGGMIQLXIO-UHFFFAOYSA-N
XLogP5.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.46
LogP ≤ 55.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea?
The IUPAC name of 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea (CID 67473122) is 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea.
What is the SMILES notation for 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea?
The canonical SMILES for 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea is C=C(C)c1cccc(C(C)(C)NC(=O)Nc2ccc3ccccc3c2)c1.
What is the InChIKey of 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea?
The InChIKey is LDDSRGGMIQLXIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O/c1-16(2)18-10-7-11-20(14-18)23(3,4)25-22(26)24-21-13-12-17-8-5-6-9-19(17)15-21/h5-15H,1H2,2-4H3,(H2,24,25,26).
What are the key properties of 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea?
1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea has a molecular weight of 344.46 g/mol, XLogP of 5.93, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea is sourced from PubChem (CID 67473122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).