2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene

C19H41N — CID 142067744

IUPAC2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene
SMILESCC=C(C)C.CCCCCCCCC(CC)CN(C)C
InChIInChI=1S/C14H31N.C5H10/c1-5-7-8-9-10-11-12-14(6-2)13-15(3)4;1-4-5(2)3/h14H,5-13H2,1-4H3;4H,1-3H3
InChIKeyVZPBMNRITFXRLW-UHFFFAOYSA-N
MW283.54 g/mol
LogP6.30
Rot. Bonds10

About 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene

2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene (PubChem CID 142067744) has the molecular formula C19H41N and a molecular weight of 283.54 g/mol. Its IUPAC name is 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene.

Molecular Properties

Compound Name2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene
PubChem CID142067744
Molecular FormulaC19H41N
Molecular Weight283.54 g/mol
Exact Mass283.32
IUPAC Name2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene
SMILESCC=C(C)C.CCCCCCCCC(CC)CN(C)C
InChIInChI=1S/C14H31N.C5H10/c1-5-7-8-9-10-11-12-14(6-2)13-15(3)4;1-4-5(2)3/h14H,5-13H2,1-4H3;4H,1-3H3
InChIKeyVZPBMNRITFXRLW-UHFFFAOYSA-N
XLogP6.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.54
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-N,N-dimethylundecan-1-amine
CID 87794341
N,N-dimethyl-2-octyldodecan-1-amine
CID 21291112
N,N-dimethyl-2-nonylhenicosan-1-amine
CID 175192311
3-ethylpentacosane
CID 22224239
3-ethylicosane
CID 528487
12-ethylhentriacontane
CID 91805956
15-ethyltetratriacontane
CID 23358557
7-ethyltetracosane
CID 22223872
7-ethyltetradecane
CID 529902
(2S)-N,N-dimethyl-2-nonylhenicosa-12,15-dien-1-amine
CID 175125330
N,N-dimethyl-10-methylidene-2-(8-methylidene-12-pentylheptadecyl)-14-pentylnonadecan-1-amine
CID 170071949
ethane;3-ethylundecane
CID 144815521

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene?
The IUPAC name of 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene (CID 142067744) is 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene.
What is the SMILES notation for 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene?
The canonical SMILES for 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene is CC=C(C)C.CCCCCCCCC(CC)CN(C)C.
What is the InChIKey of 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene?
The InChIKey is VZPBMNRITFXRLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N.C5H10/c1-5-7-8-9-10-11-12-14(6-2)13-15(3)4;1-4-5(2)3/h14H,5-13H2,1-4H3;4H,1-3H3.
What are the key properties of 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene?
2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene has a molecular weight of 283.54 g/mol, XLogP of 6.30, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,N-dimethyldecan-1-amine;2-methylbut-2-ene is sourced from PubChem (CID 142067744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).