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

C12H11ClN2O2 — CID 858198

IUPAC1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea
SMILESO=C(NCc1ccco1)Nc1cccc(Cl)c1
InChIInChI=1S/C12H11ClN2O2/c13-9-3-1-4-10(7-9)15-12(16)14-8-11-5-2-6-17-11/h1-7H,8H2,(H2,14,15,16)
InChIKeySFBUGIACZIJRFX-UHFFFAOYSA-N
MW250.69 g/mol
LogP3.25
Rot. Bonds3

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

1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea (PubChem CID 858198) has the molecular formula C12H11ClN2O2 and a molecular weight of 250.69 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea
PubChem CID858198
Molecular FormulaC12H11ClN2O2
Molecular Weight250.69 g/mol
Exact Mass250.05
IUPAC Name1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea
SMILESO=C(NCc1ccco1)Nc1cccc(Cl)c1
InChIInChI=1S/C12H11ClN2O2/c13-9-3-1-4-10(7-9)15-12(16)14-8-11-5-2-6-17-11/h1-7H,8H2,(H2,14,15,16)
InChIKeySFBUGIACZIJRFX-UHFFFAOYSA-N
XLogP3.25
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.69
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)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

N-(4-chlorophenyl)furan-2-carboxamide
CID 790315
1-Furfuryl-3-(4-nitrophenyl)urea
CID 239710
1-Furfuryl-3-(3-nitrophenyl)urea
CID 239941
1-(4-Bromophenyl)-3-furfurylurea
CID 239940
1-Furfuryl-3-phenyl-2-thiourea
CID 689750
N-(3-chlorophenyl)furan-2-carboxamide
CID 282652
1-(2-Chlorophenyl)-3-(furan-2-ylmethyl)thiourea
CID 2796408
1-(Furan-2-ylmethyl)-3-[4-(sulfamoylamino)phenyl]urea
CID 71273628
N-(4-chlorophenyl)-N'-(2-furylmethyl)thiourea
CID 841941
N-(4-amino-2-chlorophenyl)furan-2-carboxamide
CID 721121
N-[(furan-2-yl)methyl]aniline
CID 57541
4-chloro-N-(furan-2-ylmethyl)aniline
CID 968932

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea?
The IUPAC name of 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea (CID 858198) is 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea.
What is the SMILES notation for 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea?
The canonical SMILES for 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea is O=C(NCc1ccco1)Nc1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea?
The InChIKey is SFBUGIACZIJRFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O2/c13-9-3-1-4-10(7-9)15-12(16)14-8-11-5-2-6-17-11/h1-7H,8H2,(H2,14,15,16).
What are the key properties of 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea?
1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea has a molecular weight of 250.69 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-(furan-2-ylmethyl)urea is sourced from PubChem (CID 858198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).