1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine

C12H21N3O — CID 79509868

IUPAC1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCCC1CC2(CCO1)CN=C(N)N2C1CC1
InChIInChI=1S/C12H21N3O/c1-2-10-7-12(5-6-16-10)8-14-11(13)15(12)9-3-4-9/h9-10H,2-8H2,1H3,(H2,13,14)
InChIKeyLCSSUACJPTZHBL-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.11
Rot. Bonds2

About 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine

1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine (PubChem CID 79509868) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
PubChem CID79509868
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCCC1CC2(CCO1)CN=C(N)N2C1CC1
InChIInChI=1S/C12H21N3O/c1-2-10-7-12(5-6-16-10)8-14-11(13)15(12)9-3-4-9/h9-10H,2-8H2,1H3,(H2,13,14)
InChIKeyLCSSUACJPTZHBL-UHFFFAOYSA-N
XLogP1.11
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-7-methyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79521132
1-benzyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79506331
1-cyclopentyl-8-ethyl-1,3-diazaspiro[4.4]non-2-en-2-amine
CID 79520870
1-cyclopropyl-9-oxa-1,3-diazaspiro[4.6]undec-2-en-2-amine
CID 79509973
1-cyclopropyl-1,3-diazaspiro[4.11]hexadec-2-en-2-amine
CID 79509216
1-benzyl-7-propyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79498152
1-cyclopentyl-8-propyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79521648
1-cyclopropyl-5,5-diethyl-4H-imidazol-2-amine
CID 79509325
1-(4-chlorophenyl)-7-propyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79502357
1-cyclopentyl-9-propyl-1,3,9-triazaspiro[4.6]undec-2-en-2-amine
CID 79520778
1-(3-fluorophenyl)-7-propyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79503075
1-cycloheptyl-8-propyl-1,3,8-triazaspiro[4.5]dec-2-en-2-amine
CID 79496898

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The IUPAC name of 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine (CID 79509868) is 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine.
What is the SMILES notation for 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The canonical SMILES for 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine is CCC1CC2(CCO1)CN=C(N)N2C1CC1.
What is the InChIKey of 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The InChIKey is LCSSUACJPTZHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-2-10-7-12(5-6-16-10)8-14-11(13)15(12)9-3-4-9/h9-10H,2-8H2,1H3,(H2,13,14).
What are the key properties of 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine?
1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine has a molecular weight of 223.32 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-7-ethyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine is sourced from PubChem (CID 79509868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).