7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine

C14H27N3 — CID 79496589

IUPAC7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCC(C)CN1C(N)=NCC12CC(C)CC(C)C2
InChIInChI=1S/C14H27N3/c1-10(2)8-17-13(15)16-9-14(17)6-11(3)5-12(4)7-14/h10-12H,5-9H2,1-4H3,(H2,15,16)
InChIKeyBKTLKPVXMOLUKM-UHFFFAOYSA-N
MW237.39 g/mol
LogP2.47
Rot. Bonds2

About 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine

7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine (PubChem CID 79496589) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine.

Molecular Properties

Compound Name7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine
PubChem CID79496589
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCC(C)CN1C(N)=NCC12CC(C)CC(C)C2
InChIInChI=1S/C14H27N3/c1-10(2)8-17-13(15)16-9-14(17)6-11(3)5-12(4)7-14/h10-12H,5-9H2,1-4H3,(H2,15,16)
InChIKeyBKTLKPVXMOLUKM-UHFFFAOYSA-N
XLogP2.47
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The IUPAC name of 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine (CID 79496589) is 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine.
What is the SMILES notation for 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The canonical SMILES for 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine is CC(C)CN1C(N)=NCC12CC(C)CC(C)C2.
What is the InChIKey of 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The InChIKey is BKTLKPVXMOLUKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-10(2)8-17-13(15)16-9-14(17)6-11(3)5-12(4)7-14/h10-12H,5-9H2,1-4H3,(H2,15,16).
What are the key properties of 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine?
7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine has a molecular weight of 237.39 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9-dimethyl-1-(2-methylpropyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine is sourced from PubChem (CID 79496589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).