(2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide

C13H26N2O2 — CID 145399681

IUPAC(2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide
SMILESCCCCN(C)C(=O)CNC(=O)[C@H](C)CCC
InChIInChI=1S/C13H26N2O2/c1-5-7-9-15(4)12(16)10-14-13(17)11(3)8-6-2/h11H,5-10H2,1-4H3,(H,14,17)/t11-/m1/s1
InChIKeyZOSXXPGYIXPGQH-LLVKDONJSA-N
MW242.36 g/mol
LogP1.80
Rot. Bonds8

About (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide

(2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide (PubChem CID 145399681) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide.

Molecular Properties

Compound Name(2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide
PubChem CID145399681
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name(2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide
SMILESCCCCN(C)C(=O)CNC(=O)[C@H](C)CCC
InChIInChI=1S/C13H26N2O2/c1-5-7-9-15(4)12(16)10-14-13(17)11(3)8-6-2/h11H,5-10H2,1-4H3,(H,14,17)/t11-/m1/s1
InChIKeyZOSXXPGYIXPGQH-LLVKDONJSA-N
XLogP1.80
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(3-methyl-2-oxobutyl)pentanamide
CID 64996979
2-[[butyl(methyl)carbamoyl]amino]pentanoic acid
CID 61184623
3-[methyl-[2-(2-methylpentanoylamino)ethylcarbamoyl]amino]propanoic acid
CID 122015297
N-butyl-N-methyl-3-oxobutanamide
CID 60934379
(2S)-2-amino-3-methyl-N-[2-[methyl-[3-(methylamino)propyl]amino]-2-oxoethyl]butanamide
CID 82962028
(2R)-2-(carbamoylamino)-N-[2-(dimethylamino)-2-oxoethyl]pentanamide
CID 94200506
N,N-dibutyl-2-methylpentanamide
CID 2904869
2-methyl-N-[2-(methylamino)ethyl]pentanamide
CID 62659666
4-(2-methylpentanoylamino)butanoic acid
CID 43209777
N,N'-dibutyl-N'-methylpropanediamide
CID 108941430
N-butan-2-yl-N'-butyl-N'-methylpropanediamide
CID 108941812
N-butyl-N,2-dimethylpropanamide
CID 21413636

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide?
The IUPAC name of (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide (CID 145399681) is (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide.
What is the SMILES notation for (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide?
The canonical SMILES for (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide is CCCCN(C)C(=O)CNC(=O)[C@H](C)CCC.
What is the InChIKey of (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide?
The InChIKey is ZOSXXPGYIXPGQH-LLVKDONJSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-5-7-9-15(4)12(16)10-14-13(17)11(3)8-6-2/h11H,5-10H2,1-4H3,(H,14,17)/t11-/m1/s1.
What are the key properties of (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide?
(2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide has a molecular weight of 242.36 g/mol, XLogP of 1.80, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-methylpentanamide is sourced from PubChem (CID 145399681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).