(4R,9R)-spiro[4.4]nonane-4,9-diamine

C9H18N2 — CID 45098389

IUPAC(4R,9R)-spiro[4.4]nonane-4,9-diamine
SMILESN[C@@H]1CCCC12CCC[C@H]2N
InChIInChI=1S/C9H18N2/c10-7-3-1-5-9(7)6-2-4-8(9)11/h7-8H,1-6,10-11H2/t7-,8-,9?/m1/s1
InChIKeyBNILUWOCEPQBHS-ZAZKALAHSA-N
MW154.26 g/mol
LogP1.00
Rot. Bonds

About (4R,9R)-spiro[4.4]nonane-4,9-diamine

(4R,9R)-spiro[4.4]nonane-4,9-diamine (PubChem CID 45098389) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (4R,9R)-spiro[4.4]nonane-4,9-diamine.

Molecular Properties

Compound Name(4R,9R)-spiro[4.4]nonane-4,9-diamine
PubChem CID45098389
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(4R,9R)-spiro[4.4]nonane-4,9-diamine
SMILESN[C@@H]1CCCC12CCC[C@H]2N
InChIInChI=1S/C9H18N2/c10-7-3-1-5-9(7)6-2-4-8(9)11/h7-8H,1-6,10-11H2/t7-,8-,9?/m1/s1
InChIKeyBNILUWOCEPQBHS-ZAZKALAHSA-N
XLogP1.00
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4R)-spiro[4.4]nonane-4,9-diamine
CID 67207240
2-methylspiro[2.4]heptan-7-amine
CID 146817135
11-methylspiro[5.5]undecan-5-amine
CID 138665061
dichloroplatinum(2+);propanedioate;(4S,9S)-spiro[4.4]nonane-4,9-diamine
CID 71498793
N-(9-aminospiro[4.4]nonan-4-yl)acetamide
CID 121370272
1,2-diaminocyclopentan-1-ol
CID 22410822
(5S,6S)-tricyclo[4.3.0.01,5]nonane
CID 144518883
2,2-diethylcyclopentan-1-amine
CID 165447049
(8S)-spiro[2.5]octan-8-amine
CID 89147381
(8R)-spiro[2.5]octan-8-amine
CID 89147380
spiro[5.6]dodecan-12-amine
CID 15021866
(2S)-2-aminocyclopentane-1,1-dicarboxylic acid
CID 67575555

Frequently Asked Questions

What is the IUPAC name of (4R,9R)-spiro[4.4]nonane-4,9-diamine?
The IUPAC name of (4R,9R)-spiro[4.4]nonane-4,9-diamine (CID 45098389) is (4R,9R)-spiro[4.4]nonane-4,9-diamine.
What is the SMILES notation for (4R,9R)-spiro[4.4]nonane-4,9-diamine?
The canonical SMILES for (4R,9R)-spiro[4.4]nonane-4,9-diamine is N[C@@H]1CCCC12CCC[C@H]2N.
What is the InChIKey of (4R,9R)-spiro[4.4]nonane-4,9-diamine?
The InChIKey is BNILUWOCEPQBHS-ZAZKALAHSA-N. The full InChI is InChI=1S/C9H18N2/c10-7-3-1-5-9(7)6-2-4-8(9)11/h7-8H,1-6,10-11H2/t7-,8-,9?/m1/s1.
What are the key properties of (4R,9R)-spiro[4.4]nonane-4,9-diamine?
(4R,9R)-spiro[4.4]nonane-4,9-diamine has a molecular weight of 154.26 g/mol, XLogP of 1.00, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,9R)-spiro[4.4]nonane-4,9-diamine is sourced from PubChem (CID 45098389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).