N,5-diethylpentadecan-6-amine

C19H41N — CID 115831438

IUPACN,5-diethylpentadecan-6-amine
SMILESCCCCCCCCCC(NCC)C(CC)CCCC
InChIInChI=1S/C19H41N/c1-5-9-11-12-13-14-15-17-19(20-8-4)18(7-3)16-10-6-2/h18-20H,5-17H2,1-4H3
InChIKeyLSLZWKPHTBHNDX-UHFFFAOYSA-N
MW283.54 g/mol
LogP6.32
Rot. Bonds15

About N,5-diethylpentadecan-6-amine

N,5-diethylpentadecan-6-amine (PubChem CID 115831438) has the molecular formula C19H41N and a molecular weight of 283.54 g/mol. Its IUPAC name is N,5-diethylpentadecan-6-amine.

Molecular Properties

Compound NameN,5-diethylpentadecan-6-amine
PubChem CID115831438
Molecular FormulaC19H41N
Molecular Weight283.54 g/mol
Exact Mass283.32
IUPAC NameN,5-diethylpentadecan-6-amine
SMILESCCCCCCCCCC(NCC)C(CC)CCCC
InChIInChI=1S/C19H41N/c1-5-9-11-12-13-14-15-17-19(20-8-4)18(7-3)16-10-6-2/h18-20H,5-17H2,1-4H3
InChIKeyLSLZWKPHTBHNDX-UHFFFAOYSA-N
XLogP6.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.54
LogP ≤ 56.32
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

N,5-diethylnonan-4-amine
CID 83051951
5-ethyl-N-propyltetradecan-6-amine
CID 115835262
5,6-diethyldodecane
CID 90761715
N-ethyl-5-methyltridecan-6-amine
CID 114246331
5-butyl-6-ethyldodecane
CID 529932
9,10-diethyloctadecane
CID 530164
1-cyclopentyl-N,4-diethyloctan-3-amine
CID 114193299
N-ethyl-2,3-dimethylundecan-4-amine
CID 115832523
(4S)-4-ethyl-N-pentylnonan-3-amine
CID 89384517
N-ethyl-2,3-dimethyldecan-4-amine
CID 115833855
3-ethoxy-N-ethylundecan-4-amine
CID 116716862
19-heptadecan-3-ylnonatriacontane
CID 57212477

Frequently Asked Questions

What is the IUPAC name of N,5-diethylpentadecan-6-amine?
The IUPAC name of N,5-diethylpentadecan-6-amine (CID 115831438) is N,5-diethylpentadecan-6-amine.
What is the SMILES notation for N,5-diethylpentadecan-6-amine?
The canonical SMILES for N,5-diethylpentadecan-6-amine is CCCCCCCCCC(NCC)C(CC)CCCC.
What is the InChIKey of N,5-diethylpentadecan-6-amine?
The InChIKey is LSLZWKPHTBHNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H41N/c1-5-9-11-12-13-14-15-17-19(20-8-4)18(7-3)16-10-6-2/h18-20H,5-17H2,1-4H3.
What are the key properties of N,5-diethylpentadecan-6-amine?
N,5-diethylpentadecan-6-amine has a molecular weight of 283.54 g/mol, XLogP of 6.32, 15 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-diethylpentadecan-6-amine is sourced from PubChem (CID 115831438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).