1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine

C13H23N3 — CID 79509311

IUPAC1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCC1CCC(C)C2(CN=C(N)N2C2CC2)C1
InChIInChI=1S/C13H23N3/c1-9-3-4-10(2)13(7-9)8-15-12(14)16(13)11-5-6-11/h9-11H,3-8H2,1-2H3,(H2,14,15)
InChIKeyROIKFNMPRDCODB-UHFFFAOYSA-N
MW221.35 g/mol
LogP1.97
Rot. Bonds1

About 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine

1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine (PubChem CID 79509311) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
PubChem CID79509311
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCC1CCC(C)C2(CN=C(N)N2C2CC2)C1
InChIInChI=1S/C13H23N3/c1-9-3-4-10(2)13(7-9)8-15-12(14)16(13)11-5-6-11/h9-11H,3-8H2,1-2H3,(H2,14,15)
InChIKeyROIKFNMPRDCODB-UHFFFAOYSA-N
XLogP1.97
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The IUPAC name of 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine (CID 79509311) is 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine.
What is the SMILES notation for 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The canonical SMILES for 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine is CC1CCC(C)C2(CN=C(N)N2C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The InChIKey is ROIKFNMPRDCODB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-9-3-4-10(2)13(7-9)8-15-12(14)16(13)11-5-6-11/h9-11H,3-8H2,1-2H3,(H2,14,15).
What are the key properties of 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine?
1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine has a molecular weight of 221.35 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-6,9-dimethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine is sourced from PubChem (CID 79509311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).