1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine

C15H30N4 — CID 79496722

IUPAC1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine
SMILESCCC1CCCC2(CC1)CN=C(N)N2CCN(C)C
InChIInChI=1S/C15H30N4/c1-4-13-6-5-8-15(9-7-13)12-17-14(16)19(15)11-10-18(2)3/h13H,4-12H2,1-3H3,(H2,16,17)
InChIKeyAGDFLOXWLSRTLT-UHFFFAOYSA-N
MW266.43 g/mol
LogP1.91
Rot. Bonds4

About 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine

1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine (PubChem CID 79496722) has the molecular formula C15H30N4 and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine
PubChem CID79496722
Molecular FormulaC15H30N4
Molecular Weight266.43 g/mol
Exact Mass266.25
IUPAC Name1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine
SMILESCCC1CCCC2(CC1)CN=C(N)N2CCN(C)C
InChIInChI=1S/C15H30N4/c1-4-13-6-5-8-15(9-7-13)12-17-14(16)19(15)11-10-18(2)3/h13H,4-12H2,1-3H3,(H2,16,17)
InChIKeyAGDFLOXWLSRTLT-UHFFFAOYSA-N
XLogP1.91
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine (CID 79496722) is 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine is CCC1CCCC2(CC1)CN=C(N)N2CCN(C)C.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine?
The InChIKey is AGDFLOXWLSRTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4/c1-4-13-6-5-8-15(9-7-13)12-17-14(16)19(15)11-10-18(2)3/h13H,4-12H2,1-3H3,(H2,16,17).
What are the key properties of 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine?
1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine has a molecular weight of 266.43 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-8-ethyl-1,3-diazaspiro[4.6]undec-2-en-2-amine is sourced from PubChem (CID 79496722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).