5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide

C12H26N2O — CID 104683623

IUPAC5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide
SMILESCCC(C)N(CC)C(=O)C(C)CCCN
InChIInChI=1S/C12H26N2O/c1-5-11(4)14(6-2)12(15)10(3)8-7-9-13/h10-11H,5-9,13H2,1-4H3
InChIKeyIVENWXLXFWFXTL-UHFFFAOYSA-N
MW214.35 g/mol
LogP2.01
Rot. Bonds7

About 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide

5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide (PubChem CID 104683623) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide
PubChem CID104683623
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide
SMILESCCC(C)N(CC)C(=O)C(C)CCCN
InChIInChI=1S/C12H26N2O/c1-5-11(4)14(6-2)12(15)10(3)8-7-9-13/h10-11H,5-9,13H2,1-4H3
InChIKeyIVENWXLXFWFXTL-UHFFFAOYSA-N
XLogP2.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-methylpentanamide
CID 104684492
5-amino-N-ethyl-N-(2-ethylbutyl)-2-methylpentanamide
CID 113440847
4-amino-N-butan-2-yl-N-ethylbutanamide
CID 43274608
5-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)pentanamide
CID 104684451
5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide
CID 104683482
3-amino-N-butan-2-yl-N-ethylpropanamide
CID 43274458
5-amino-N,N-dihexyl-2-methylpentanamide
CID 104684478
2-[(5-amino-2-methylpentanoyl)-propylamino]acetic acid
CID 115867094
2-amino-N-butan-2-yl-N-ethyl-5-methoxypentanamide
CID 81082232
(2R)-2-amino-N-butan-2-yl-N-ethyl-4-methylpentanamide
CID 104902610
7-amino-2,4-dimethylheptan-3-one
CID 116613359
4-[butan-2-yl(ethyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103495920

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide?
The IUPAC name of 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide (CID 104683623) is 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide.
What is the SMILES notation for 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide?
The canonical SMILES for 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide is CCC(C)N(CC)C(=O)C(C)CCCN.
What is the InChIKey of 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide?
The InChIKey is IVENWXLXFWFXTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-11(4)14(6-2)12(15)10(3)8-7-9-13/h10-11H,5-9,13H2,1-4H3.
What are the key properties of 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide?
5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide has a molecular weight of 214.35 g/mol, XLogP of 2.01, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide is sourced from PubChem (CID 104683623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).