(2-oxo-1-propyl-3H-indol-3-yl)urea

C12H15N3O2 — CID 150324372

IUPAC(2-oxo-1-propyl-3H-indol-3-yl)urea
SMILESCCCN1C(=O)C(NC(N)=O)c2ccccc21
InChIInChI=1S/C12H15N3O2/c1-2-7-15-9-6-4-3-5-8(9)10(11(15)16)14-12(13)17/h3-6,10H,2,7H2,1H3,(H3,13,14,17)
InChIKeyGOHWUOUKSBDLPA-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.15
Rot. Bonds3

About (2-oxo-1-propyl-3H-indol-3-yl)urea

(2-oxo-1-propyl-3H-indol-3-yl)urea (PubChem CID 150324372) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is (2-oxo-1-propyl-3H-indol-3-yl)urea.

Molecular Properties

Compound Name(2-oxo-1-propyl-3H-indol-3-yl)urea
PubChem CID150324372
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name(2-oxo-1-propyl-3H-indol-3-yl)urea
SMILESCCCN1C(=O)C(NC(N)=O)c2ccccc21
InChIInChI=1S/C12H15N3O2/c1-2-7-15-9-6-4-3-5-8(9)10(11(15)16)14-12(13)17/h3-6,10H,2,7H2,1H3,(H3,13,14,17)
InChIKeyGOHWUOUKSBDLPA-UHFFFAOYSA-N
XLogP1.15
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-oxo-1-propyl-3H-indol-3-yl)urea?
The IUPAC name of (2-oxo-1-propyl-3H-indol-3-yl)urea (CID 150324372) is (2-oxo-1-propyl-3H-indol-3-yl)urea.
What is the SMILES notation for (2-oxo-1-propyl-3H-indol-3-yl)urea?
The canonical SMILES for (2-oxo-1-propyl-3H-indol-3-yl)urea is CCCN1C(=O)C(NC(N)=O)c2ccccc21.
What is the InChIKey of (2-oxo-1-propyl-3H-indol-3-yl)urea?
The InChIKey is GOHWUOUKSBDLPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-2-7-15-9-6-4-3-5-8(9)10(11(15)16)14-12(13)17/h3-6,10H,2,7H2,1H3,(H3,13,14,17).
What are the key properties of (2-oxo-1-propyl-3H-indol-3-yl)urea?
(2-oxo-1-propyl-3H-indol-3-yl)urea has a molecular weight of 233.27 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-1-propyl-3H-indol-3-yl)urea is sourced from PubChem (CID 150324372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).