2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide

C16H32N2O2 — CID 143358661

IUPAC2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide
SMILESCCCC(C(=O)NC(CC(C)=O)CC(C)CC)N(C)C
InChIInChI=1S/C16H32N2O2/c1-7-9-15(18(5)6)16(20)17-14(11-13(4)19)10-12(3)8-2/h12,14-15H,7-11H2,1-6H3,(H,17,20)
InChIKeyDCGPCUFCVNBKAY-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.62
Rot. Bonds10

About 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide

2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide (PubChem CID 143358661) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide
PubChem CID143358661
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide
SMILESCCCC(C(=O)NC(CC(C)=O)CC(C)CC)N(C)C
InChIInChI=1S/C16H32N2O2/c1-7-9-15(18(5)6)16(20)17-14(11-13(4)19)10-12(3)8-2/h12,14-15H,7-11H2,1-6H3,(H,17,20)
InChIKeyDCGPCUFCVNBKAY-UHFFFAOYSA-N
XLogP2.62
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4R,6R)-4,6-dimethyloctan-2-one
CID 15199451
3-[(2-arsanylacetyl)amino]-5-methylheptanoic acid
CID 173182030
3-(acetamidomethyl)-5-methylheptanoic acid
CID 11333384
(3S,5R)-3-[[(1R)-1-acetyloxyethoxy]carbonylamino]-5-methylheptanoic acid
CID 87296210
ethane;4-methylheptan-2-one
CID 142986053
4,7-dimethylnonan-2-one
CID 87291820
(4S)-4-ethylheptan-2-one
CID 87332428
(2S,4S)-4-methyl-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoic acid
CID 10467743
3-[[acetyl(amino)amino]methyl]-5-methyloctanoic acid
CID 87609990
2-(dimethylamino)-4-methyl-N-propan-2-ylpentanamide
CID 170685859
(3S,5S)-3-(aminomethyl)-5-methyloctanoic acid
CID 57024808
3-(dimethylamino)hexanoic acid
CID 64527574

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide?
The IUPAC name of 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide (CID 143358661) is 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide.
What is the SMILES notation for 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide?
The canonical SMILES for 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide is CCCC(C(=O)NC(CC(C)=O)CC(C)CC)N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide?
The InChIKey is DCGPCUFCVNBKAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-7-9-15(18(5)6)16(20)17-14(11-13(4)19)10-12(3)8-2/h12,14-15H,7-11H2,1-6H3,(H,17,20).
What are the key properties of 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide?
2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide has a molecular weight of 284.44 g/mol, XLogP of 2.62, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(6-methyl-2-oxooctan-4-yl)pentanamide is sourced from PubChem (CID 143358661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).