1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea

C13H14N2O2 — CID 2787280

IUPAC1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)NCc1ccco1
InChIInChI=1S/C13H14N2O2/c1-10-5-2-3-7-12(10)15-13(16)14-9-11-6-4-8-17-11/h2-8H,9H2,1H3,(H2,14,15,16)
InChIKeyJDFYBIQKXZAMMA-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.91
Rot. Bonds3

About 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea

1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea (PubChem CID 2787280) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea
PubChem CID2787280
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)NCc1ccco1
InChIInChI=1S/C13H14N2O2/c1-10-5-2-3-7-12(10)15-13(16)14-9-11-6-4-8-17-11/h2-8H,9H2,1H3,(H2,14,15,16)
InChIKeyJDFYBIQKXZAMMA-UHFFFAOYSA-N
XLogP2.91
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea with MolForge

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

Launch Full Analysis

Related Compounds

1-Furfuryl-3-(4-nitrophenyl)urea
CID 239710
N-(4-methylphenyl)furan-2-carboxamide
CID 785196
1-(Furan-2-ylmethyl)-3-(2-methylphenyl)thiourea
CID 694026
1-Furfuryl-3-(3-nitrophenyl)urea
CID 239941
1-(4-Bromophenyl)-3-furfurylurea
CID 239940
1-Furfuryl-3-phenyl-2-thiourea
CID 689750
1-(Furan-2-ylmethyl)-3-[4-(sulfamoylamino)phenyl]urea
CID 71273628
1-[1-(3-Methylfuran-2-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 118409083
5-(2-Furanylmethyl)tetrahydro-1-phenyl-1,3,5-triazine-2(1H)-thione
CID 754478
Pyrimidine-5-carbonitrile, 2-furan-2-yl-6-mercapto-4-oxo-1-phenyl-1,2,3,4-tetrahydro-
CID 3157044
5-(2-Furylmethyl)-1-(4-methylphenyl)-1,3,5-triazinane-2-thione
CID 3546592
1-(4-Acetylphenyl)-3-(furan-2-ylmethyl)thiourea
CID 863535

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea?
The IUPAC name of 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea (CID 2787280) is 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea.
What is the SMILES notation for 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea?
The canonical SMILES for 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea is Cc1ccccc1NC(=O)NCc1ccco1.
What is the InChIKey of 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea?
The InChIKey is JDFYBIQKXZAMMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-10-5-2-3-7-12(10)15-13(16)14-9-11-6-4-8-17-11/h2-8H,9H2,1H3,(H2,14,15,16).
What are the key properties of 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea?
1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea has a molecular weight of 230.27 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-3-(2-methylphenyl)urea is sourced from PubChem (CID 2787280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).