6-oxaspiro[4.5]decan-9-ylurea

C10H18N2O2 — CID 127598348

IUPAC6-oxaspiro[4.5]decan-9-ylurea
SMILESNC(=O)NC1CCOC2(CCCC2)C1
InChIInChI=1S/C10H18N2O2/c11-9(13)12-8-3-6-14-10(7-8)4-1-2-5-10/h8H,1-7H2,(H3,11,12,13)
InChIKeyOFDNEMFWQAXTLH-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.15
Rot. Bonds1

About 6-oxaspiro[4.5]decan-9-ylurea

6-oxaspiro[4.5]decan-9-ylurea (PubChem CID 127598348) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 6-oxaspiro[4.5]decan-9-ylurea.

Molecular Properties

Compound Name6-oxaspiro[4.5]decan-9-ylurea
PubChem CID127598348
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name6-oxaspiro[4.5]decan-9-ylurea
SMILESNC(=O)NC1CCOC2(CCCC2)C1
InChIInChI=1S/C10H18N2O2/c11-9(13)12-8-3-6-14-10(7-8)4-1-2-5-10/h8H,1-7H2,(H3,11,12,13)
InChIKeyOFDNEMFWQAXTLH-UHFFFAOYSA-N
XLogP1.15
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-oxaspiro[3.5]nonan-8-ylurea
CID 131086736
N-(1-oxaspiro[5.5]undecan-4-yl)acetamide
CID 51358556
2-(6-oxaspiro[4.5]decan-9-ylamino)ethylurea
CID 83120645
1-cyclobutyl-1-methyl-3-[(4S)-1-oxaspiro[5.5]undecan-4-yl]urea
CID 97235748
1-[(1S)-1-(oxan-4-yl)ethyl]-3-[(9S)-6-oxaspiro[4.5]decan-9-yl]urea
CID 97235034
(2S)-2-hydroxy-N-[(4R)-1-oxaspiro[5.5]undecan-4-yl]-2-phenylacetamide
CID 97235901
ethyl 2-(6-oxaspiro[4.5]decan-9-ylamino)acetate
CID 79895269
N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine
CID 79895616
N-cyclohexyl-1-oxaspiro[5.5]undecan-4-amine
CID 79898516
N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide
CID 71968225
6-(6-oxaspiro[4.5]decan-9-ylamino)pyrazine-2-carboxamide
CID 133377773
1-[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-3-[(4R)-1-oxaspiro[5.5]undecan-4-yl]urea
CID 97235500

Frequently Asked Questions

What is the IUPAC name of 6-oxaspiro[4.5]decan-9-ylurea?
The IUPAC name of 6-oxaspiro[4.5]decan-9-ylurea (CID 127598348) is 6-oxaspiro[4.5]decan-9-ylurea.
What is the SMILES notation for 6-oxaspiro[4.5]decan-9-ylurea?
The canonical SMILES for 6-oxaspiro[4.5]decan-9-ylurea is NC(=O)NC1CCOC2(CCCC2)C1.
What is the InChIKey of 6-oxaspiro[4.5]decan-9-ylurea?
The InChIKey is OFDNEMFWQAXTLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c11-9(13)12-8-3-6-14-10(7-8)4-1-2-5-10/h8H,1-7H2,(H3,11,12,13).
What are the key properties of 6-oxaspiro[4.5]decan-9-ylurea?
6-oxaspiro[4.5]decan-9-ylurea has a molecular weight of 198.27 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxaspiro[4.5]decan-9-ylurea is sourced from PubChem (CID 127598348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).