1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine

C10H19N3 — CID 79509728

IUPAC1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine
SMILESCCN1C(N)=NCC12CCCC2C
InChIInChI=1S/C10H19N3/c1-3-13-9(11)12-7-10(13)6-4-5-8(10)2/h8H,3-7H2,1-2H3,(H2,11,12)
InChIKeyWCPBAZZARCBFNY-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.20
Rot. Bonds1

About 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine

1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine (PubChem CID 79509728) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine.

Molecular Properties

Compound Name1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine
PubChem CID79509728
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine
SMILESCCN1C(N)=NCC12CCCC2C
InChIInChI=1S/C10H19N3/c1-3-13-9(11)12-7-10(13)6-4-5-8(10)2/h8H,3-7H2,1-2H3,(H2,11,12)
InChIKeyWCPBAZZARCBFNY-UHFFFAOYSA-N
XLogP1.20
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine?
The IUPAC name of 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine (CID 79509728) is 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine.
What is the SMILES notation for 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine?
The canonical SMILES for 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine is CCN1C(N)=NCC12CCCC2C.
What is the InChIKey of 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine?
The InChIKey is WCPBAZZARCBFNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-3-13-9(11)12-7-10(13)6-4-5-8(10)2/h8H,3-7H2,1-2H3,(H2,11,12).
What are the key properties of 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine?
1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine has a molecular weight of 181.28 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-9-methyl-1,3-diazaspiro[4.4]non-2-en-2-amine is sourced from PubChem (CID 79509728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).