5-ethyltetradecan-6-amine

C16H35N — CID 115835159

IUPAC5-ethyltetradecan-6-amine
SMILESCCCCCCCCC(N)C(CC)CCCC
InChIInChI=1S/C16H35N/c1-4-7-9-10-11-12-14-16(17)15(6-3)13-8-5-2/h15-16H,4-14,17H2,1-3H3
InChIKeyMFQLAHVKXCZFOS-UHFFFAOYSA-N
MW241.46 g/mol
LogP5.28
Rot. Bonds12

About 5-ethyltetradecan-6-amine

5-ethyltetradecan-6-amine (PubChem CID 115835159) has the molecular formula C16H35N and a molecular weight of 241.46 g/mol. Its IUPAC name is 5-ethyltetradecan-6-amine.

Molecular Properties

Compound Name5-ethyltetradecan-6-amine
PubChem CID115835159
Molecular FormulaC16H35N
Molecular Weight241.46 g/mol
Exact Mass241.28
IUPAC Name5-ethyltetradecan-6-amine
SMILESCCCCCCCCC(N)C(CC)CCCC
InChIInChI=1S/C16H35N/c1-4-7-9-10-11-12-14-16(17)15(6-3)13-8-5-2/h15-16H,4-14,17H2,1-3H3
InChIKeyMFQLAHVKXCZFOS-UHFFFAOYSA-N
XLogP5.28
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500241.46
LogP ≤ 55.28
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

5,9-diethyltridecane-6,8-diamine
CID 57146972
5,6-diethyldodecane
CID 90761715
5,15-diethylnonadecane-5,14-diamine
CID 15610190
5-butyl-6-ethyldodecane
CID 529932
hexadecane-6,7-diamine
CID 57245820
9,10-diethyloctadecane
CID 530164
tritriacontane-16,17-diamine
CID 57106039
hexatriacontane-18,19-diamine
CID 57054547
13-ethylhexadecane-1,12-diamine
CID 151701600
9-nonylheptacosane-1,10-diamine;dihydrofluoride
CID 174769166
19-heptadecan-3-ylnonatriacontane
CID 57212477
6-ethyl-7-pentyltetradecane
CID 123140274

Frequently Asked Questions

What is the IUPAC name of 5-ethyltetradecan-6-amine?
The IUPAC name of 5-ethyltetradecan-6-amine (CID 115835159) is 5-ethyltetradecan-6-amine.
What is the SMILES notation for 5-ethyltetradecan-6-amine?
The canonical SMILES for 5-ethyltetradecan-6-amine is CCCCCCCCC(N)C(CC)CCCC.
What is the InChIKey of 5-ethyltetradecan-6-amine?
The InChIKey is MFQLAHVKXCZFOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N/c1-4-7-9-10-11-12-14-16(17)15(6-3)13-8-5-2/h15-16H,4-14,17H2,1-3H3.
What are the key properties of 5-ethyltetradecan-6-amine?
5-ethyltetradecan-6-amine has a molecular weight of 241.46 g/mol, XLogP of 5.28, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyltetradecan-6-amine is sourced from PubChem (CID 115835159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).