6-methyl-2,8-diazaspiro[3.6]dec-5-ene

C9H16N2 — CID 167293761

IUPAC6-methyl-2,8-diazaspiro[3.6]dec-5-ene
SMILESCC1=CC2(CCNC1)CNC2
InChIInChI=1S/C9H16N2/c1-8-4-9(6-11-7-9)2-3-10-5-8/h4,10-11H,2-3,5-7H2,1H3
InChIKeyRDQRQTZUNKXNFA-UHFFFAOYSA-N
MW152.24 g/mol
LogP0.52
Rot. Bonds

About 6-methyl-2,8-diazaspiro[3.6]dec-5-ene

6-methyl-2,8-diazaspiro[3.6]dec-5-ene (PubChem CID 167293761) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 6-methyl-2,8-diazaspiro[3.6]dec-5-ene.

Molecular Properties

Compound Name6-methyl-2,8-diazaspiro[3.6]dec-5-ene
PubChem CID167293761
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name6-methyl-2,8-diazaspiro[3.6]dec-5-ene
SMILESCC1=CC2(CCNC1)CNC2
InChIInChI=1S/C9H16N2/c1-8-4-9(6-11-7-9)2-3-10-5-8/h4,10-11H,2-3,5-7H2,1H3
InChIKeyRDQRQTZUNKXNFA-UHFFFAOYSA-N
XLogP0.52
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-methyl-2-azaspiro[3.3]hept-6-ene
CID 164585353
3,3,5-trimethyl-2,6-dihydro-1H-pyridine
CID 154201736
2,7-diazaspiro[4.4]non-3-ene
CID 23135247
2,7-diazaspiro[3.4]octane;ethane
CID 143687523
2,7-diazaspiro[3.4]octane;ethane
CID 171068778
3-methyl-3-phenylpyrrolidine
CID 21098616
7,7-dimethyl-1,4-diazepan-2-one;molecular hydrogen
CID 143599230
9-bromo-5,5-dimethyl-1,2,3,4-tetrahydro-2-benzazepine
CID 84729232
5-methyl-2-(3-methylpyrrolidin-3-yl)-1,3-benzoxazole
CID 63144900
3,7,11,14,18,22-hexazabicyclo[22.2.2]octacosa-1(26),24,27-triene
CID 10510676
2,7-diazaspiro[3.4]octane;propane
CID 177136819
4-(3-methylpyrrolidin-3-yl)aniline
CID 117050230

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,8-diazaspiro[3.6]dec-5-ene?
The IUPAC name of 6-methyl-2,8-diazaspiro[3.6]dec-5-ene (CID 167293761) is 6-methyl-2,8-diazaspiro[3.6]dec-5-ene.
What is the SMILES notation for 6-methyl-2,8-diazaspiro[3.6]dec-5-ene?
The canonical SMILES for 6-methyl-2,8-diazaspiro[3.6]dec-5-ene is CC1=CC2(CCNC1)CNC2.
What is the InChIKey of 6-methyl-2,8-diazaspiro[3.6]dec-5-ene?
The InChIKey is RDQRQTZUNKXNFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-8-4-9(6-11-7-9)2-3-10-5-8/h4,10-11H,2-3,5-7H2,1H3.
What are the key properties of 6-methyl-2,8-diazaspiro[3.6]dec-5-ene?
6-methyl-2,8-diazaspiro[3.6]dec-5-ene has a molecular weight of 152.24 g/mol, XLogP of 0.52, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,8-diazaspiro[3.6]dec-5-ene is sourced from PubChem (CID 167293761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).