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

C16H35N — CID 63508452

IUPAC2,2-diethyl-N-propan-2-ylnonan-1-amine
SMILESCCCCCCCC(CC)(CC)CNC(C)C
InChIInChI=1S/C16H35N/c1-6-9-10-11-12-13-16(7-2,8-3)14-17-15(4)5/h15,17H,6-14H2,1-5H3
InChIKeyDZLJEPPNRPMNJA-UHFFFAOYSA-N
MW241.46 g/mol
LogP5.15
Rot. Bonds11

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

2,2-diethyl-N-propan-2-ylnonan-1-amine (PubChem CID 63508452) has the molecular formula C16H35N and a molecular weight of 241.46 g/mol. Its IUPAC name is 2,2-diethyl-N-propan-2-ylnonan-1-amine.

Molecular Properties

Compound Name2,2-diethyl-N-propan-2-ylnonan-1-amine
PubChem CID63508452
Molecular FormulaC16H35N
Molecular Weight241.46 g/mol
Exact Mass241.28
IUPAC Name2,2-diethyl-N-propan-2-ylnonan-1-amine
SMILESCCCCCCCC(CC)(CC)CNC(C)C
InChIInChI=1S/C16H35N/c1-6-9-10-11-12-13-16(7-2,8-3)14-17-15(4)5/h15,17H,6-14H2,1-5H3
InChIKeyDZLJEPPNRPMNJA-UHFFFAOYSA-N
XLogP5.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500241.46
LogP ≤ 55.15
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-yldodecan-1-amine
CID 63509498
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-ylnonan-1-amine?
The IUPAC name of 2,2-diethyl-N-propan-2-ylnonan-1-amine (CID 63508452) is 2,2-diethyl-N-propan-2-ylnonan-1-amine.
What is the SMILES notation for 2,2-diethyl-N-propan-2-ylnonan-1-amine?
The canonical SMILES for 2,2-diethyl-N-propan-2-ylnonan-1-amine is CCCCCCCC(CC)(CC)CNC(C)C.
What is the InChIKey of 2,2-diethyl-N-propan-2-ylnonan-1-amine?
The InChIKey is DZLJEPPNRPMNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N/c1-6-9-10-11-12-13-16(7-2,8-3)14-17-15(4)5/h15,17H,6-14H2,1-5H3.
What are the key properties of 2,2-diethyl-N-propan-2-ylnonan-1-amine?
2,2-diethyl-N-propan-2-ylnonan-1-amine has a molecular weight of 241.46 g/mol, XLogP of 5.15, 11 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-ylnonan-1-amine is sourced from PubChem (CID 63508452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).