(2-methylfuran-3-yl)methylurea

C7H10N2O2 — CID 130639643

IUPAC(2-methylfuran-3-yl)methylurea
SMILESCc1occc1CNC(N)=O
InChIInChI=1S/C7H10N2O2/c1-5-6(2-3-11-5)4-9-7(8)10/h2-3H,4H2,1H3,(H3,8,9,10)
InChIKeyQURHEZQEQYREAV-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.76
Rot. Bonds2

About (2-methylfuran-3-yl)methylurea

(2-methylfuran-3-yl)methylurea (PubChem CID 130639643) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is (2-methylfuran-3-yl)methylurea.

Molecular Properties

Compound Name(2-methylfuran-3-yl)methylurea
PubChem CID130639643
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name(2-methylfuran-3-yl)methylurea
SMILESCc1occc1CNC(N)=O
InChIInChI=1S/C7H10N2O2/c1-5-6(2-3-11-5)4-9-7(8)10/h2-3H,4H2,1H3,(H3,8,9,10)
InChIKeyQURHEZQEQYREAV-UHFFFAOYSA-N
XLogP0.76
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromo-2,6-dimethylphenyl)-3-[(2-methylfuran-3-yl)methyl]urea
CID 71937795
2-(2-methylfuran-3-yl)ethanethioate
CID 22731656
(2-methylfuran-3-yl)methyl acetate
CID 71480019
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
CID 61370638
1-[(2R)-2-hydroxy-2-(2-methylphenyl)ethyl]-3-[(2-methylfuran-3-yl)methyl]urea
CID 96530805
3-(cyanomethylsulfamoyl)-4-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 56803681
1-[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]-3-[(2-methylfuran-3-yl)methyl]urea
CID 97066307
1-[1-(2-bromophenyl)ethyl]-3-[(2-methylfuran-3-yl)methyl]urea
CID 60569703
1-[(1R,2S)-2-cyclohexylcyclopropyl]-3-[(2-methylfuran-3-yl)methyl]urea
CID 139010942
(3R)-3-[[ethyl(methyl)amino]methyl]-N-[(2-methylfuran-3-yl)methyl]pyrrolidine-1-carboxamide
CID 97099166
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide
CID 61371044
(2-bromo-3-methylphenyl)methylurea
CID 91662331

Frequently Asked Questions

What is the IUPAC name of (2-methylfuran-3-yl)methylurea?
The IUPAC name of (2-methylfuran-3-yl)methylurea (CID 130639643) is (2-methylfuran-3-yl)methylurea.
What is the SMILES notation for (2-methylfuran-3-yl)methylurea?
The canonical SMILES for (2-methylfuran-3-yl)methylurea is Cc1occc1CNC(N)=O.
What is the InChIKey of (2-methylfuran-3-yl)methylurea?
The InChIKey is QURHEZQEQYREAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5-6(2-3-11-5)4-9-7(8)10/h2-3H,4H2,1H3,(H3,8,9,10).
What are the key properties of (2-methylfuran-3-yl)methylurea?
(2-methylfuran-3-yl)methylurea has a molecular weight of 154.17 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylfuran-3-yl)methylurea is sourced from PubChem (CID 130639643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).