2-butyl-2-ethyl-N-propyldecan-1-amine

C19H41N — CID 63508776

IUPAC2-butyl-2-ethyl-N-propyldecan-1-amine
SMILESCCCCCCCCC(CC)(CCCC)CNCCC
InChIInChI=1S/C19H41N/c1-5-9-11-12-13-14-16-19(8-4,15-10-6-2)18-20-17-7-3/h20H,5-18H2,1-4H3
InChIKeyRDTMYRKECLMISH-UHFFFAOYSA-N
MW283.54 g/mol
LogP6.32
Rot. Bonds15

About 2-butyl-2-ethyl-N-propyldecan-1-amine

2-butyl-2-ethyl-N-propyldecan-1-amine (PubChem CID 63508776) has the molecular formula C19H41N and a molecular weight of 283.54 g/mol. Its IUPAC name is 2-butyl-2-ethyl-N-propyldecan-1-amine.

Molecular Properties

Compound Name2-butyl-2-ethyl-N-propyldecan-1-amine
PubChem CID63508776
Molecular FormulaC19H41N
Molecular Weight283.54 g/mol
Exact Mass283.32
IUPAC Name2-butyl-2-ethyl-N-propyldecan-1-amine
SMILESCCCCCCCCC(CC)(CCCC)CNCCC
InChIInChI=1S/C19H41N/c1-5-9-11-12-13-14-16-19(8-4,15-10-6-2)18-20-17-7-3/h20H,5-18H2,1-4H3
InChIKeyRDTMYRKECLMISH-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

2,2-diethyl-N-propylnonan-1-amine
CID 63507422
2-butyl-2-ethyl-N-(2-methoxyethyl)octan-1-amine
CID 63508620
2,2-diethyl-N-propylbutan-1-amine
CID 62724441
7-butyl-7-ethyltetradecane
CID 174665936
2-ethyl-N-propyl-2-[3-(2,2,2-trifluoroethoxy)propyl]hexan-1-amine
CID 62726032
2-ethyl-2-[2-(3-methoxypropoxy)ethyl]-N-propylhexan-1-amine
CID 103183523
2,2-dimethyl-N-propyltetradecan-1-amine
CID 63521984
2,2-dimethyl-N-propyloctan-1-amine
CID 63522518
10,10-dibutylicosane
CID 151498539
2-ethyl-2-[(nonylamino)methyl]butan-1-ol
CID 114164917
2-(chloromethyl)-2-ethyl-N-heptylbutan-1-amine
CID 106252175
2,2-diethyl-N'-octylpropane-1,3-diamine
CID 115568699

Frequently Asked Questions

What is the IUPAC name of 2-butyl-2-ethyl-N-propyldecan-1-amine?
The IUPAC name of 2-butyl-2-ethyl-N-propyldecan-1-amine (CID 63508776) is 2-butyl-2-ethyl-N-propyldecan-1-amine.
What is the SMILES notation for 2-butyl-2-ethyl-N-propyldecan-1-amine?
The canonical SMILES for 2-butyl-2-ethyl-N-propyldecan-1-amine is CCCCCCCCC(CC)(CCCC)CNCCC.
What is the InChIKey of 2-butyl-2-ethyl-N-propyldecan-1-amine?
The InChIKey is RDTMYRKECLMISH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H41N/c1-5-9-11-12-13-14-16-19(8-4,15-10-6-2)18-20-17-7-3/h20H,5-18H2,1-4H3.
What are the key properties of 2-butyl-2-ethyl-N-propyldecan-1-amine?
2-butyl-2-ethyl-N-propyldecan-1-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 2-butyl-2-ethyl-N-propyldecan-1-amine is sourced from PubChem (CID 63508776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).