[2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine

C9H20N4 — CID 156523812

IUPAC[2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine
SMILESNCN1CCC2(CC1)CN(CN)C2
InChIInChI=1S/C9H20N4/c10-7-12-3-1-9(2-4-12)5-13(6-9)8-11/h1-8,10-11H2
InChIKeyHGWVXKYFFWJCLO-UHFFFAOYSA-N
MW184.29 g/mol
LogP-0.78
Rot. Bonds2

About [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine

[2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine (PubChem CID 156523812) has the molecular formula C9H20N4 and a molecular weight of 184.29 g/mol. Its IUPAC name is [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine.

Molecular Properties

Compound Name[2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine
PubChem CID156523812
Molecular FormulaC9H20N4
Molecular Weight184.29 g/mol
Exact Mass184.17
IUPAC Name[2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine
SMILESNCN1CCC2(CC1)CN(CN)C2
InChIInChI=1S/C9H20N4/c10-7-12-3-1-9(2-4-12)5-13(6-9)8-11/h1-8,10-11H2
InChIKeyHGWVXKYFFWJCLO-UHFFFAOYSA-N
XLogP-0.78
TPSA58.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.29
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine?
The IUPAC name of [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine (CID 156523812) is [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine.
What is the SMILES notation for [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine?
The canonical SMILES for [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine is NCN1CCC2(CC1)CN(CN)C2.
What is the InChIKey of [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine?
The InChIKey is HGWVXKYFFWJCLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4/c10-7-12-3-1-9(2-4-12)5-13(6-9)8-11/h1-8,10-11H2.
What are the key properties of [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine?
[2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine has a molecular weight of 184.29 g/mol, XLogP of -0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanamine is sourced from PubChem (CID 156523812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).