potassium;octadecan-1-amine;chloride

C18H39ClKN — CID 174768392

IUPACpotassium;octadecan-1-amine;chloride
SMILESCCCCCCCCCCCCCCCCCCN.[Cl-].[K+]
InChIInChI=1S/C18H39N.ClH.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;;/h2-19H2,1H3;1H;/q;;+1/p-1
InChIKeyYGKGFWVXQJHOFY-UHFFFAOYSA-M
MW344.07 g/mol
LogP0.21
Rot. Bonds16

About potassium;octadecan-1-amine;chloride

potassium;octadecan-1-amine;chloride (PubChem CID 174768392) has the molecular formula C18H39ClKN and a molecular weight of 344.07 g/mol. Its IUPAC name is potassium;octadecan-1-amine;chloride.

Molecular Properties

Compound Namepotassium;octadecan-1-amine;chloride
PubChem CID174768392
Molecular FormulaC18H39ClKN
Molecular Weight344.07 g/mol
Exact Mass343.24
IUPAC Namepotassium;octadecan-1-amine;chloride
SMILESCCCCCCCCCCCCCCCCCCN.[Cl-].[K+]
InChIInChI=1S/C18H39N.ClH.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;;/h2-19H2,1H3;1H;/q;;+1/p-1
InChIKeyYGKGFWVXQJHOFY-UHFFFAOYSA-M
XLogP0.21
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.07
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tridecan-1-amine;undecan-1-amine
CID 23045943
butane-1,4-diamine;hexan-1-amine
CID 162097736
decan-1-amine;hexan-1-amine
CID 162216125
hexacosan-1-amine
CID 14550481
dotetracontan-1-amine
CID 14550497
tripotassium;hydride;octadecan-1-amine;hydrochloride
CID 174410869
hexan-1-amine;dihydrate
CID 174459608
methanamine;tridecan-1-amine
CID 22649914
octadecan-1-amine;trihydrochloride
CID 175177898
copper;hexan-1-amine
CID 87269039
nonan-1-amine;dihydrate
CID 174770026
pentadecan-1-amine;hydrobromide
CID 173087623

Frequently Asked Questions

What is the IUPAC name of potassium;octadecan-1-amine;chloride?
The IUPAC name of potassium;octadecan-1-amine;chloride (CID 174768392) is potassium;octadecan-1-amine;chloride.
What is the SMILES notation for potassium;octadecan-1-amine;chloride?
The canonical SMILES for potassium;octadecan-1-amine;chloride is CCCCCCCCCCCCCCCCCCN.[Cl-].[K+].
What is the InChIKey of potassium;octadecan-1-amine;chloride?
The InChIKey is YGKGFWVXQJHOFY-UHFFFAOYSA-M. The full InChI is InChI=1S/C18H39N.ClH.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;;/h2-19H2,1H3;1H;/q;;+1/p-1.
What are the key properties of potassium;octadecan-1-amine;chloride?
potassium;octadecan-1-amine;chloride has a molecular weight of 344.07 g/mol, XLogP of 0.21, 16 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;octadecan-1-amine;chloride is sourced from PubChem (CID 174768392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).