ethane;N-methyl-N-propan-2-ylnonanamide

C15H33NO — CID 142045586

IUPACethane;N-methyl-N-propan-2-ylnonanamide
SMILESCC.CCCCCCCCC(=O)N(C)C(C)C
InChIInChI=1S/C13H27NO.C2H6/c1-5-6-7-8-9-10-11-13(15)14(4)12(2)3;1-2/h12H,5-11H2,1-4H3;1-2H3
InChIKeyCGRJPNNDOSCPLL-UHFFFAOYSA-N
MW243.43 g/mol
LogP4.63
Rot. Bonds8

About ethane;N-methyl-N-propan-2-ylnonanamide

ethane;N-methyl-N-propan-2-ylnonanamide (PubChem CID 142045586) has the molecular formula C15H33NO and a molecular weight of 243.43 g/mol. Its IUPAC name is ethane;N-methyl-N-propan-2-ylnonanamide.

Molecular Properties

Compound Nameethane;N-methyl-N-propan-2-ylnonanamide
PubChem CID142045586
Molecular FormulaC15H33NO
Molecular Weight243.43 g/mol
Exact Mass243.26
IUPAC Nameethane;N-methyl-N-propan-2-ylnonanamide
SMILESCC.CCCCCCCCC(=O)N(C)C(C)C
InChIInChI=1S/C13H27NO.C2H6/c1-5-6-7-8-9-10-11-13(15)14(4)12(2)3;1-2/h12H,5-11H2,1-4H3;1-2H3
InChIKeyCGRJPNNDOSCPLL-UHFFFAOYSA-N
XLogP4.63
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[heptanoyl(methyl)amino]propanoic acid
CID 62626215
(2S)-2-[methyl(octadecanoyl)amino]propanoic acid
CID 20689915
N,9-dimethyl-N-propan-2-yldecanamide
CID 170241261
N,8-dimethyl-N-propan-2-ylnonanamide
CID 170241265
N-(4-aminobutan-2-yl)-N-methylheptanamide
CID 114751924
N-(1-cyanopropan-2-yl)-N-methyldodecanamide
CID 63296980
N-(1-amino-1-sulfanylidenepropan-2-yl)-N-methylnonanamide
CID 65448406
N,N-dimethyldecanamide;N,N-dimethyloctanamide
CID 155099591
N-decanoyl-N-methyldecanamide
CID 141076390
N-(1-bromopropan-2-yl)-N-methylpentanamide
CID 104556286
cobalt;N-hydroxy-N-propan-2-yldecanamide
CID 88603876
bis[[(2S)-2-[methyl(octadecanoyl)amino]propanoyl]oxy]alumanyl (2S)-2-[methyl(octadecanoyl)amino]propanoate
CID 139835757

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-N-propan-2-ylnonanamide?
The IUPAC name of ethane;N-methyl-N-propan-2-ylnonanamide (CID 142045586) is ethane;N-methyl-N-propan-2-ylnonanamide.
What is the SMILES notation for ethane;N-methyl-N-propan-2-ylnonanamide?
The canonical SMILES for ethane;N-methyl-N-propan-2-ylnonanamide is CC.CCCCCCCCC(=O)N(C)C(C)C.
What is the InChIKey of ethane;N-methyl-N-propan-2-ylnonanamide?
The InChIKey is CGRJPNNDOSCPLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO.C2H6/c1-5-6-7-8-9-10-11-13(15)14(4)12(2)3;1-2/h12H,5-11H2,1-4H3;1-2H3.
What are the key properties of ethane;N-methyl-N-propan-2-ylnonanamide?
ethane;N-methyl-N-propan-2-ylnonanamide has a molecular weight of 243.43 g/mol, XLogP of 4.63, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-N-propan-2-ylnonanamide is sourced from PubChem (CID 142045586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).