decan-1-amine

C10H23N — CID 8916

IUPACdecan-1-amine
SMILESCCCCCCCCCCN
InChIInChI=1S/C10H23N/c1-2-3-4-5-6-7-8-9-10-11/h2-11H2,1H3
InChIKeyMHZGKXUYDGKKIU-UHFFFAOYSA-N
MW157.30 g/mol
LogP3.09
Rot. Bonds8

About decan-1-amine

decan-1-amine (PubChem CID 8916) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is decan-1-amine.

Molecular Properties

Compound Namedecan-1-amine
PubChem CID8916
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Namedecan-1-amine
SMILESCCCCCCCCCCN
InChIInChI=1S/C10H23N/c1-2-3-4-5-6-7-8-9-10-11/h2-11H2,1H3
InChIKeyMHZGKXUYDGKKIU-UHFFFAOYSA-N
XLogP3.09
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze decan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Octylamine
CID 8143
2-Aminoheptane
CID 5603
1,8-Octanediamine
CID 24250
Octadecylamine
CID 15793
Hexadecylamine
CID 8926
1,10-Decanediamine
CID 1317
Tetradecylamine
CID 16217
Dodecylamine
CID 13583
1-Heptanamine
CID 8127
Nonylamine
CID 16215
1,12-Dodecanediamine
CID 17727
Pentadecylamine
CID 17386

Frequently Asked Questions

What is the IUPAC name of decan-1-amine?
The IUPAC name of decan-1-amine (CID 8916) is decan-1-amine.
What is the SMILES notation for decan-1-amine?
The canonical SMILES for decan-1-amine is CCCCCCCCCCN.
What is the InChIKey of decan-1-amine?
The InChIKey is MHZGKXUYDGKKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N/c1-2-3-4-5-6-7-8-9-10-11/h2-11H2,1H3.
What are the key properties of decan-1-amine?
decan-1-amine has a molecular weight of 157.30 g/mol, XLogP of 3.09, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for decan-1-amine is sourced from PubChem (CID 8916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).