2,2-diethyl-N-propan-2-yldodecan-1-amine

C19H41N — CID 63509498

IUPAC2,2-diethyl-N-propan-2-yldodecan-1-amine
SMILESCCCCCCCCCCC(CC)(CC)CNC(C)C
InChIInChI=1S/C19H41N/c1-6-9-10-11-12-13-14-15-16-19(7-2,8-3)17-20-18(4)5/h18,20H,6-17H2,1-5H3
InChIKeyQUJNDMFPFUKHTF-UHFFFAOYSA-N
MW283.54 g/mol
LogP6.32
Rot. Bonds14

About 2,2-diethyl-N-propan-2-yldodecan-1-amine

2,2-diethyl-N-propan-2-yldodecan-1-amine (PubChem CID 63509498) has the molecular formula C19H41N and a molecular weight of 283.54 g/mol. Its IUPAC name is 2,2-diethyl-N-propan-2-yldodecan-1-amine.

Molecular Properties

Compound Name2,2-diethyl-N-propan-2-yldodecan-1-amine
PubChem CID63509498
Molecular FormulaC19H41N
Molecular Weight283.54 g/mol
Exact Mass283.32
IUPAC Name2,2-diethyl-N-propan-2-yldodecan-1-amine
SMILESCCCCCCCCCCC(CC)(CC)CNC(C)C
InChIInChI=1S/C19H41N/c1-6-9-10-11-12-13-14-15-16-19(7-2,8-3)17-20-18(4)5/h18,20H,6-17H2,1-5H3
InChIKeyQUJNDMFPFUKHTF-UHFFFAOYSA-N
XLogP6.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
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-propan-2-ylnonan-1-amine
CID 63508452
2-butyl-2,4-diethyl-N-propan-2-ylhexan-1-amine
CID 82930458
2,2-diethyl-6-methyl-N-propan-2-ylheptan-1-amine
CID 83169784
2-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-N-propan-2-ylhexan-1-amine
CID 112591502
2,2-diethyl-N-propylnonan-1-amine
CID 63507422
7-butyl-7-ethyltetradecane
CID 174665936
2,2-diethyl-4-ethylsulfonyl-N-propan-2-ylbutan-1-amine
CID 62724247
19-hexadecyl-19-nonylnonatriacontane
CID 90913331
6,6-dipentylpentadecane
CID 152650171
9,9-dioctyloctadecane
CID 19690418
8-hexyl-8-pentylhexadecane
CID 521602
3-ethyl-3-[(hexan-2-ylamino)methyl]pentan-1-ol
CID 115726149

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N-propan-2-yldodecan-1-amine?
The IUPAC name of 2,2-diethyl-N-propan-2-yldodecan-1-amine (CID 63509498) is 2,2-diethyl-N-propan-2-yldodecan-1-amine.
What is the SMILES notation for 2,2-diethyl-N-propan-2-yldodecan-1-amine?
The canonical SMILES for 2,2-diethyl-N-propan-2-yldodecan-1-amine is CCCCCCCCCCC(CC)(CC)CNC(C)C.
What is the InChIKey of 2,2-diethyl-N-propan-2-yldodecan-1-amine?
The InChIKey is QUJNDMFPFUKHTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H41N/c1-6-9-10-11-12-13-14-15-16-19(7-2,8-3)17-20-18(4)5/h18,20H,6-17H2,1-5H3.
What are the key properties of 2,2-diethyl-N-propan-2-yldodecan-1-amine?
2,2-diethyl-N-propan-2-yldodecan-1-amine has a molecular weight of 283.54 g/mol, XLogP of 6.32, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-N-propan-2-yldodecan-1-amine is sourced from PubChem (CID 63509498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).