3-aminononan-1-ol;hydrochloride

C9H22ClNO — CID 55255753

IUPAC3-aminononan-1-ol;hydrochloride
SMILESCCCCCCC(N)CCO.Cl
InChIInChI=1S/C9H21NO.ClH/c1-2-3-4-5-6-9(10)7-8-11;/h9,11H,2-8,10H2,1H3;1H
InChIKeyCHPDQRWSFKXOSJ-UHFFFAOYSA-N
MW195.73 g/mol
LogP2.09
Rot. Bonds7

About 3-aminononan-1-ol;hydrochloride

3-aminononan-1-ol;hydrochloride (PubChem CID 55255753) has the molecular formula C9H22ClNO and a molecular weight of 195.73 g/mol. Its IUPAC name is 3-aminononan-1-ol;hydrochloride.

Molecular Properties

Compound Name3-aminononan-1-ol;hydrochloride
PubChem CID55255753
Molecular FormulaC9H22ClNO
Molecular Weight195.73 g/mol
Exact Mass195.14
IUPAC Name3-aminononan-1-ol;hydrochloride
SMILESCCCCCCC(N)CCO.Cl
InChIInChI=1S/C9H21NO.ClH/c1-2-3-4-5-6-9(10)7-8-11;/h9,11H,2-8,10H2,1H3;1H
InChIKeyCHPDQRWSFKXOSJ-UHFFFAOYSA-N
XLogP2.09
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.73
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

henicosane-8,14-diamine;dihydrochloride
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octadecan-9-amine;hydrochloride
CID 19002510
pentacosan-7-amine
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nonapentacontan-30-amine
CID 118952570
decan-4-amine;hydrochloride
CID 87728109
nonan-4-amine;hydrochloride
CID 86176929
heptadecan-4-amine;hydrochloride
CID 173248342
(2S)-2-aminoundecan-1-ol
CID 98129192
2-aminononadecan-1-ol
CID 87201322
nonadecane-2,14-diamine
CID 89095951
(3S)-3-aminohexan-1-ol;sulfane;hydrochloride
CID 161031770
(4R)-tridecan-4-amine
CID 150614684

Frequently Asked Questions

What is the IUPAC name of 3-aminononan-1-ol;hydrochloride?
The IUPAC name of 3-aminononan-1-ol;hydrochloride (CID 55255753) is 3-aminononan-1-ol;hydrochloride.
What is the SMILES notation for 3-aminononan-1-ol;hydrochloride?
The canonical SMILES for 3-aminononan-1-ol;hydrochloride is CCCCCCC(N)CCO.Cl.
What is the InChIKey of 3-aminononan-1-ol;hydrochloride?
The InChIKey is CHPDQRWSFKXOSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO.ClH/c1-2-3-4-5-6-9(10)7-8-11;/h9,11H,2-8,10H2,1H3;1H.
What are the key properties of 3-aminononan-1-ol;hydrochloride?
3-aminononan-1-ol;hydrochloride has a molecular weight of 195.73 g/mol, XLogP of 2.09, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminononan-1-ol;hydrochloride is sourced from PubChem (CID 55255753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).