1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea

C10H19N3O — CID 115589802

IUPAC1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea
SMILESCN1CCCC(NC(=O)NC2CC2)C1
InChIInChI=1S/C10H19N3O/c1-13-6-2-3-9(7-13)12-10(14)11-8-4-5-8/h8-9H,2-7H2,1H3,(H2,11,12,14)
InChIKeyCJVVFZWWMRMFLT-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.54
Rot. Bonds2

About 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea

1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea (PubChem CID 115589802) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea
PubChem CID115589802
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea
SMILESCN1CCCC(NC(=O)NC2CC2)C1
InChIInChI=1S/C10H19N3O/c1-13-6-2-3-9(7-13)12-10(14)11-8-4-5-8/h8-9H,2-7H2,1H3,(H2,11,12,14)
InChIKeyCJVVFZWWMRMFLT-UHFFFAOYSA-N
XLogP0.54
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea?
The IUPAC name of 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea (CID 115589802) is 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea?
The canonical SMILES for 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea is CN1CCCC(NC(=O)NC2CC2)C1.
What is the InChIKey of 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea?
The InChIKey is CJVVFZWWMRMFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-13-6-2-3-9(7-13)12-10(14)11-8-4-5-8/h8-9H,2-7H2,1H3,(H2,11,12,14).
What are the key properties of 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea?
1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea has a molecular weight of 197.28 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(1-methylpiperidin-3-yl)urea is sourced from PubChem (CID 115589802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).