2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide

C14H30N2O — CID 114138368

IUPAC2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide
SMILESCCCCC(CCC)NC(=O)C(C)(C)NCC
InChIInChI=1S/C14H30N2O/c1-6-9-11-12(10-7-2)16-13(17)14(4,5)15-8-3/h12,15H,6-11H2,1-5H3,(H,16,17)
InChIKeyYGTJXHBLQMAYDA-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.85
Rot. Bonds9

About 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide

2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide (PubChem CID 114138368) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide
PubChem CID114138368
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide
SMILESCCCCC(CCC)NC(=O)C(C)(C)NCC
InChIInChI=1S/C14H30N2O/c1-6-9-11-12(10-7-2)16-13(17)14(4,5)15-8-3/h12,15H,6-11H2,1-5H3,(H,16,17)
InChIKeyYGTJXHBLQMAYDA-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(ethylamino)-N-[(2R)-1-hydroxybutan-2-yl]-2-methylpropanamide
CID 107221411
2-(ethylamino)-2-methyl-N-(3-methylbutan-2-yl)propanamide
CID 62833567
3,3-dimethyl-2-(octan-4-ylcarbamoyl)butanoic acid
CID 106021463
N-octan-4-ylpentanamide
CID 91803774
(2R)-2-amino-N-octan-4-ylpentanamide
CID 103797903
2-(ethylamino)-2-methyl-N-octylpropanamide
CID 113337256
2-[[2-(ethylamino)-2-methylpropanoyl]amino]butanoic acid
CID 62835349
N-(dicyclopropylmethyl)-2-(ethylamino)-2-methylpropanamide
CID 62836306
2-methyl-3-(octan-4-ylamino)-3-oxopropanoic acid
CID 106021991
2,2,3-trimethyl-3-(octan-4-ylcarbamoylamino)butanoic acid
CID 106020545
2-[[2-(ethylamino)-2-methylpropanoyl]amino]-4-hydroxybutanoic acid
CID 62835355
2,2-dimethyl-4-(octan-4-ylcarbamoylamino)-4-oxobutanoic acid
CID 106019803

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide?
The IUPAC name of 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide (CID 114138368) is 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide.
What is the SMILES notation for 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide?
The canonical SMILES for 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide is CCCCC(CCC)NC(=O)C(C)(C)NCC.
What is the InChIKey of 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide?
The InChIKey is YGTJXHBLQMAYDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-6-9-11-12(10-7-2)16-13(17)14(4,5)15-8-3/h12,15H,6-11H2,1-5H3,(H,16,17).
What are the key properties of 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide?
2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide has a molecular weight of 242.41 g/mol, XLogP of 2.85, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-N-octan-4-ylpropanamide is sourced from PubChem (CID 114138368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).