2,2-di(propan-2-yl)decanediamide

C16H32N2O2 — CID 174837671

IUPAC2,2-di(propan-2-yl)decanediamide
SMILESCC(C)C(CCCCCCCC(N)=O)(C(N)=O)C(C)C
InChIInChI=1S/C16H32N2O2/c1-12(2)16(13(3)4,15(18)20)11-9-7-5-6-8-10-14(17)19/h12-13H,5-11H2,1-4H3,(H2,17,19)(H2,18,20)
InChIKeyADYIPPPTKMIWJO-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.99
Rot. Bonds11

About 2,2-di(propan-2-yl)decanediamide

2,2-di(propan-2-yl)decanediamide (PubChem CID 174837671) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2,2-di(propan-2-yl)decanediamide.

Molecular Properties

Compound Name2,2-di(propan-2-yl)decanediamide
PubChem CID174837671
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2,2-di(propan-2-yl)decanediamide
SMILESCC(C)C(CCCCCCCC(N)=O)(C(N)=O)C(C)C
InChIInChI=1S/C16H32N2O2/c1-12(2)16(13(3)4,15(18)20)11-9-7-5-6-8-10-14(17)19/h12-13H,5-11H2,1-4H3,(H2,17,19)(H2,18,20)
InChIKeyADYIPPPTKMIWJO-UHFFFAOYSA-N
XLogP2.99
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

21-methyldotetracontanediamide
CID 87333254
2,2-di(propan-2-yl)nonanedioate
CID 18794999
docosanediamide;hexacosanediamide
CID 129179979
dodecanediamide;nonanediamide
CID 175017820
pentadecanediamide
CID 87429217
nonatetracontanediamide
CID 162734608
but-2-enoic acid;2,2-di(propan-2-yl)hexanamide
CID 174913395
9-methyl-8-oxodecanamide
CID 168891746
copper;tridecanediamide
CID 159780260
dipropan-2-yl 2,2-di(propan-2-yl)decanedioate
CID 141253960
octadecanamide;bis(propan-2-ol)
CID 90014672
5,5-dimethylhexanamide;2-methylpropane
CID 161490551

Frequently Asked Questions

What is the IUPAC name of 2,2-di(propan-2-yl)decanediamide?
The IUPAC name of 2,2-di(propan-2-yl)decanediamide (CID 174837671) is 2,2-di(propan-2-yl)decanediamide.
What is the SMILES notation for 2,2-di(propan-2-yl)decanediamide?
The canonical SMILES for 2,2-di(propan-2-yl)decanediamide is CC(C)C(CCCCCCCC(N)=O)(C(N)=O)C(C)C.
What is the InChIKey of 2,2-di(propan-2-yl)decanediamide?
The InChIKey is ADYIPPPTKMIWJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-12(2)16(13(3)4,15(18)20)11-9-7-5-6-8-10-14(17)19/h12-13H,5-11H2,1-4H3,(H2,17,19)(H2,18,20).
What are the key properties of 2,2-di(propan-2-yl)decanediamide?
2,2-di(propan-2-yl)decanediamide has a molecular weight of 284.44 g/mol, XLogP of 2.99, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-di(propan-2-yl)decanediamide is sourced from PubChem (CID 174837671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).