N,N-diaminononan-5-amine

C9H23N3 — CID 88511755

IUPACN,N-diaminononan-5-amine
SMILESCCCCC(CCCC)N(N)N
InChIInChI=1S/C9H23N3/c1-3-5-7-9(12(10)11)8-6-4-2/h9H,3-8,10-11H2,1-2H3
InChIKeyUCGCLUHWCJOHRF-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.78
Rot. Bonds7

About N,N-diaminononan-5-amine

N,N-diaminononan-5-amine (PubChem CID 88511755) has the molecular formula C9H23N3 and a molecular weight of 173.30 g/mol. Its IUPAC name is N,N-diaminononan-5-amine.

Molecular Properties

Compound NameN,N-diaminononan-5-amine
PubChem CID88511755
Molecular FormulaC9H23N3
Molecular Weight173.30 g/mol
Exact Mass173.19
IUPAC NameN,N-diaminononan-5-amine
SMILESCCCCC(CCCC)N(N)N
InChIInChI=1S/C9H23N3/c1-3-5-7-9(12(10)11)8-6-4-2/h9H,3-8,10-11H2,1-2H3
InChIKeyUCGCLUHWCJOHRF-UHFFFAOYSA-N
XLogP1.78
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N-dihydroxydecan-5-amine
CID 88629686
N-butyl-N-methylnonan-5-amine
CID 175231488
N,N-dimethylicosan-5-amine
CID 19862397
2-N-methyl-2-N-(3-methylbutan-2-yl)hexane-1,2-diamine
CID 61353943
1-N',1-N'-dimethylpentane-1,1-diamine
CID 18183747
(10R)-N,N-dimethylheptacosan-10-amine
CID 134549801
N,N-dimethyltetracontan-19-amine
CID 45382230
icosane-5,10,16-triamine
CID 88870264
amino(tributyl)phosphanium chloride
CID 160955506
azane;5-butyldecane
CID 118324151
azane;tetrabutylphosphanium;chloride;hydrochloride
CID 174751452
1-[methyl(octan-4-yl)amino]butan-1-ol
CID 88539765

Frequently Asked Questions

What is the IUPAC name of N,N-diaminononan-5-amine?
The IUPAC name of N,N-diaminononan-5-amine (CID 88511755) is N,N-diaminononan-5-amine.
What is the SMILES notation for N,N-diaminononan-5-amine?
The canonical SMILES for N,N-diaminononan-5-amine is CCCCC(CCCC)N(N)N.
What is the InChIKey of N,N-diaminononan-5-amine?
The InChIKey is UCGCLUHWCJOHRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23N3/c1-3-5-7-9(12(10)11)8-6-4-2/h9H,3-8,10-11H2,1-2H3.
What are the key properties of N,N-diaminononan-5-amine?
N,N-diaminononan-5-amine has a molecular weight of 173.30 g/mol, XLogP of 1.78, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diaminononan-5-amine is sourced from PubChem (CID 88511755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).