8-aminodecanal

C10H21NO — CID 173156180

IUPAC8-aminodecanal
SMILESCCC(N)CCCCCCC=O
InChIInChI=1S/C10H21NO/c1-2-10(11)8-6-4-3-5-7-9-12/h9-10H,2-8,11H2,1H3
InChIKeyDCGKTWJWRHZZDL-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.26
Rot. Bonds8

About 8-aminodecanal

8-aminodecanal (PubChem CID 173156180) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 8-aminodecanal.

Molecular Properties

Compound Name8-aminodecanal
PubChem CID173156180
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name8-aminodecanal
SMILESCCC(N)CCCCCCC=O
InChIInChI=1S/C10H21NO/c1-2-10(11)8-6-4-3-5-7-9-12/h9-10H,2-8,11H2,1H3
InChIKeyDCGKTWJWRHZZDL-UHFFFAOYSA-N
XLogP2.26
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-Amino-1-Carbonyl Pentane
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2-Aminohexanal
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7-Aminoheptanal
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8-Aminooctanal
CID 15013112
9-Aminononanal
CID 15013113
10-Aminodecanal
CID 15013114
2-Aminoheptanedial
CID 17996793
4-(3-Aminopropyl) aminobutyraldehyde
CID 18670989
n-Decalamin
CID 20555578
2-Aminododecanal
CID 21420686
Heptanal-amine
CID 53966461
Octalamine
CID 54076326

Frequently Asked Questions

What is the IUPAC name of 8-aminodecanal?
The IUPAC name of 8-aminodecanal (CID 173156180) is 8-aminodecanal.
What is the SMILES notation for 8-aminodecanal?
The canonical SMILES for 8-aminodecanal is CCC(N)CCCCCCC=O.
What is the InChIKey of 8-aminodecanal?
The InChIKey is DCGKTWJWRHZZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-2-10(11)8-6-4-3-5-7-9-12/h9-10H,2-8,11H2,1H3.
What are the key properties of 8-aminodecanal?
8-aminodecanal has a molecular weight of 171.28 g/mol, XLogP of 2.26, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-aminodecanal is sourced from PubChem (CID 173156180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).