N-ethyltetradecan-1-amine;hydrochloride

C16H36ClN — CID 174740266

IUPACN-ethyltetradecan-1-amine;hydrochloride
SMILESCCCCCCCCCCCCCCNCC.Cl
InChIInChI=1S/C16H35N.ClH/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-4-2;/h17H,3-16H2,1-2H3;1H
InChIKeyWIPJIRUNYAUVFC-UHFFFAOYSA-N
MW277.92 g/mol
LogP5.72
Rot. Bonds14

About N-ethyltetradecan-1-amine;hydrochloride

N-ethyltetradecan-1-amine;hydrochloride (PubChem CID 174740266) has the molecular formula C16H36ClN and a molecular weight of 277.92 g/mol. Its IUPAC name is N-ethyltetradecan-1-amine;hydrochloride.

Molecular Properties

Compound NameN-ethyltetradecan-1-amine;hydrochloride
PubChem CID174740266
Molecular FormulaC16H36ClN
Molecular Weight277.92 g/mol
Exact Mass277.25
IUPAC NameN-ethyltetradecan-1-amine;hydrochloride
SMILESCCCCCCCCCCCCCCNCC.Cl
InChIInChI=1S/C16H35N.ClH/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-4-2;/h17H,3-16H2,1-2H3;1H
InChIKeyWIPJIRUNYAUVFC-UHFFFAOYSA-N
XLogP5.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500277.92
LogP ≤ 55.72
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

ethane;N-ethylhexan-1-amine
CID 143229911
N-ethyloctan-1-amine;hydrate;hydrobromide
CID 174973287
N-ethyl-N'-hexylethane-1,2-diamine
CID 7171940
N-ethyl-N'-hexadecylpropane-1,3-diamine
CID 46736046
lithium;N-ethylhexan-1-amine;hydride
CID 174419930
N-ethyl-N'-octadecylpropane-1,3-diamine
CID 175605866
N'-butyl-N-ethylnonane-1,9-diamine
CID 138750457
N-hexylhexan-1-amine;hydrochloride
CID 519999
N-octylnonan-1-amine;hydrochloride
CID 90480847
N-docosyldocosan-1-amine;hydrochloride
CID 173181498
N,N'-diethylpentane-1,5-diamine
CID 15013244
N-hexyltridecan-1-amine
CID 87659278

Frequently Asked Questions

What is the IUPAC name of N-ethyltetradecan-1-amine;hydrochloride?
The IUPAC name of N-ethyltetradecan-1-amine;hydrochloride (CID 174740266) is N-ethyltetradecan-1-amine;hydrochloride.
What is the SMILES notation for N-ethyltetradecan-1-amine;hydrochloride?
The canonical SMILES for N-ethyltetradecan-1-amine;hydrochloride is CCCCCCCCCCCCCCNCC.Cl.
What is the InChIKey of N-ethyltetradecan-1-amine;hydrochloride?
The InChIKey is WIPJIRUNYAUVFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N.ClH/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-4-2;/h17H,3-16H2,1-2H3;1H.
What are the key properties of N-ethyltetradecan-1-amine;hydrochloride?
N-ethyltetradecan-1-amine;hydrochloride has a molecular weight of 277.92 g/mol, XLogP of 5.72, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyltetradecan-1-amine;hydrochloride is sourced from PubChem (CID 174740266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).