7-azaspiro[4.5]decane-4,7-diamine

C9H19N3 — CID 143166126

IUPAC7-azaspiro[4.5]decane-4,7-diamine
SMILESNC1CCCC12CCCN(N)C2
InChIInChI=1S/C9H19N3/c10-8-3-1-4-9(8)5-2-6-12(11)7-9/h8H,1-7,10-11H2
InChIKeyWPAADNBHBKJWQT-UHFFFAOYSA-N
MW169.27 g/mol
LogP0.45
Rot. Bonds

About 7-azaspiro[4.5]decane-4,7-diamine

7-azaspiro[4.5]decane-4,7-diamine (PubChem CID 143166126) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is 7-azaspiro[4.5]decane-4,7-diamine.

Molecular Properties

Compound Name7-azaspiro[4.5]decane-4,7-diamine
PubChem CID143166126
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC Name7-azaspiro[4.5]decane-4,7-diamine
SMILESNC1CCCC12CCCN(N)C2
InChIInChI=1S/C9H19N3/c10-8-3-1-4-9(8)5-2-6-12(11)7-9/h8H,1-7,10-11H2
InChIKeyWPAADNBHBKJWQT-UHFFFAOYSA-N
XLogP0.45
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

(8S)-spiro[2.5]octan-8-amine
CID 89147381
spiro[5.6]dodecan-12-amine
CID 15021866
(8R)-spiro[2.5]octan-8-amine
CID 89147380
8-azaspiro[4.5]decan-4-amine;dihydrochloride
CID 138106142
tert-butyl 11-amino-2-azaspiro[5.5]undecane-2-carboxylate
CID 82667309
8-propan-2-yl-5-azaspiro[2.5]octan-5-amine
CID 174305339
5-tert-butyl-5-azaspiro[2.5]octan-8-amine
CID 160902227
(4R,9R)-spiro[4.4]nonane-4,9-diamine
CID 45098389
(4R)-spiro[4.4]nonane-4,9-diamine
CID 67207240
tert-butyl (3R,4S)-3-amino-6-azaspiro[3.5]nonane-6-carboxylate
CID 97294860
1,2-diaminocyclopentan-1-ol
CID 22410822
[(4S)-2-amino-2-azaspiro[4.4]nonan-4-yl]methanol
CID 129497777

Frequently Asked Questions

What is the IUPAC name of 7-azaspiro[4.5]decane-4,7-diamine?
The IUPAC name of 7-azaspiro[4.5]decane-4,7-diamine (CID 143166126) is 7-azaspiro[4.5]decane-4,7-diamine.
What is the SMILES notation for 7-azaspiro[4.5]decane-4,7-diamine?
The canonical SMILES for 7-azaspiro[4.5]decane-4,7-diamine is NC1CCCC12CCCN(N)C2.
What is the InChIKey of 7-azaspiro[4.5]decane-4,7-diamine?
The InChIKey is WPAADNBHBKJWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3/c10-8-3-1-4-9(8)5-2-6-12(11)7-9/h8H,1-7,10-11H2.
What are the key properties of 7-azaspiro[4.5]decane-4,7-diamine?
7-azaspiro[4.5]decane-4,7-diamine has a molecular weight of 169.27 g/mol, XLogP of 0.45, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-azaspiro[4.5]decane-4,7-diamine is sourced from PubChem (CID 143166126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).