2-amino-N-methyl-N-(3-methylbutyl)pentanamide

C11H24N2O — CID 60963800

IUPAC2-amino-N-methyl-N-(3-methylbutyl)pentanamide
SMILESCCCC(N)C(=O)N(C)CCC(C)C
InChIInChI=1S/C11H24N2O/c1-5-6-10(12)11(14)13(4)8-7-9(2)3/h9-10H,5-8,12H2,1-4H3
InChIKeyDJKBYFKVCDBIKS-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.62
Rot. Bonds6

About 2-amino-N-methyl-N-(3-methylbutyl)pentanamide

2-amino-N-methyl-N-(3-methylbutyl)pentanamide (PubChem CID 60963800) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(3-methylbutyl)pentanamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(3-methylbutyl)pentanamide
PubChem CID60963800
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2-amino-N-methyl-N-(3-methylbutyl)pentanamide
SMILESCCCC(N)C(=O)N(C)CCC(C)C
InChIInChI=1S/C11H24N2O/c1-5-6-10(12)11(14)13(4)8-7-9(2)3/h9-10H,5-8,12H2,1-4H3
InChIKeyDJKBYFKVCDBIKS-UHFFFAOYSA-N
XLogP1.62
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-methyl-N-(3-methylbutyl)-4-methylsulfanylbutanamide
CID 61165499
(2R)-2-amino-N-ethyl-N-methylpentanamide
CID 93255557
(2S)-2-amino-N-[3-(dimethylamino)propyl]-N-methylpentanamide
CID 107569740
(2S)-2-amino-N-methyl-N-(2-methylsulfonylethyl)pentanamide
CID 107570108
2-amino-N-(2-ethoxyethyl)-N-methylpentanamide
CID 81058843
2-amino-N-(2-cyanopropyl)-N-methylpentanamide
CID 60963784
(2S)-2-amino-N-butyl-N-methylhexanamide
CID 103830866
(2R)-2-amino-N-methyl-N-pent-4-enylpentanamide
CID 103797423
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylpentanamide
CID 107568202
(2R)-2-amino-N-hydroxy-N-methylpentanamide
CID 131057070
(2R)-2-amino-N-cyclopentyl-N-(3-methylbutyl)pentanamide
CID 103795443
(2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide
CID 107570541

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(3-methylbutyl)pentanamide?
The IUPAC name of 2-amino-N-methyl-N-(3-methylbutyl)pentanamide (CID 60963800) is 2-amino-N-methyl-N-(3-methylbutyl)pentanamide.
What is the SMILES notation for 2-amino-N-methyl-N-(3-methylbutyl)pentanamide?
The canonical SMILES for 2-amino-N-methyl-N-(3-methylbutyl)pentanamide is CCCC(N)C(=O)N(C)CCC(C)C.
What is the InChIKey of 2-amino-N-methyl-N-(3-methylbutyl)pentanamide?
The InChIKey is DJKBYFKVCDBIKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-6-10(12)11(14)13(4)8-7-9(2)3/h9-10H,5-8,12H2,1-4H3.
What are the key properties of 2-amino-N-methyl-N-(3-methylbutyl)pentanamide?
2-amino-N-methyl-N-(3-methylbutyl)pentanamide has a molecular weight of 200.33 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(3-methylbutyl)pentanamide is sourced from PubChem (CID 60963800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).