nonylurea

C10H22N2O — CID 13442645

IUPACnonylurea
SMILESCCCCCCCCCNC(N)=O
InChIInChI=1S/C10H22N2O/c1-2-3-4-5-6-7-8-9-12-10(11)13/h2-9H2,1H3,(H3,11,12,13)
InChIKeyUWOOQFOHVDZTOD-UHFFFAOYSA-N
MW186.30 g/mol
LogP2.41
Rot. Bonds8

About nonylurea

nonylurea (PubChem CID 13442645) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is nonylurea.

Molecular Properties

Compound Namenonylurea
PubChem CID13442645
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Namenonylurea
SMILESCCCCCCCCCNC(N)=O
InChIInChI=1S/C10H22N2O/c1-2-3-4-5-6-7-8-9-12-10(11)13/h2-9H2,1H3,(H3,11,12,13)
InChIKeyUWOOQFOHVDZTOD-UHFFFAOYSA-N
XLogP2.41
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of nonylurea?
The IUPAC name of nonylurea (CID 13442645) is nonylurea.
What is the SMILES notation for nonylurea?
The canonical SMILES for nonylurea is CCCCCCCCCNC(N)=O.
What is the InChIKey of nonylurea?
The InChIKey is UWOOQFOHVDZTOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-2-3-4-5-6-7-8-9-12-10(11)13/h2-9H2,1H3,(H3,11,12,13).
What are the key properties of nonylurea?
nonylurea has a molecular weight of 186.30 g/mol, XLogP of 2.41, 8 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for nonylurea is sourced from PubChem (CID 13442645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).