(2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide

C11H24N2O — CID 61154897

IUPAC(2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide
SMILESCCCC(C)N(C)C(=O)[C@@H](N)C(C)C
InChIInChI=1S/C11H24N2O/c1-6-7-9(4)13(5)11(14)10(12)8(2)3/h8-10H,6-7,12H2,1-5H3/t9?,10-/m0/s1
InChIKeyQUJAHVKAMSTUAC-AXDSSHIGSA-N
MW200.33 g/mol
LogP1.62
Rot. Bonds5

About (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide

(2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide (PubChem CID 61154897) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide.

Molecular Properties

Compound Name(2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide
PubChem CID61154897
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name(2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide
SMILESCCCC(C)N(C)C(=O)[C@@H](N)C(C)C
InChIInChI=1S/C11H24N2O/c1-6-7-9(4)13(5)11(14)10(12)8(2)3/h8-10H,6-7,12H2,1-5H3/t9?,10-/m0/s1
InChIKeyQUJAHVKAMSTUAC-AXDSSHIGSA-N
XLogP1.62
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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,3-dimethyl-N-pentan-2-ylpentanamide
CID 61173173
(2R)-2-amino-N,3-dimethyl-N-pentan-3-ylbutanamide
CID 79011778
ethyl 3,3-dimethyl-2-[methyl(pentan-2-yl)carbamoyl]butanoate
CID 116537775
3-chloro-N,2-dimethyl-N-pentan-2-ylpropanamide
CID 62726602
(2S)-2-amino-3-methyl-N,N-dipropylbutanamide
CID 22690786
(2R)-2-amino-N-methyl-N-(4-methylsulfanylbutan-2-yl)pentanamide
CID 103797446
(2S)-2-amino-N,N-dibutyl-3-methylbutanamide
CID 28983163
2-(azetidin-3-yl)-N-methyl-N-pentan-2-ylpropanamide
CID 116674919
2-amino-N-ethyl-3-methyl-N-propan-2-ylbutanamide
CID 43265863
2-amino-N,3-dimethyl-N-(2-methylpropyl)butanamide
CID 43272154
N-(2-aminoethyl)-N'-methyl-N'-pentan-2-yloxamide
CID 43571597
(2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide
CID 79012704

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide?
The IUPAC name of (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide (CID 61154897) is (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide.
What is the SMILES notation for (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide?
The canonical SMILES for (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide is CCCC(C)N(C)C(=O)[C@@H](N)C(C)C.
What is the InChIKey of (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide?
The InChIKey is QUJAHVKAMSTUAC-AXDSSHIGSA-N. The full InChI is InChI=1S/C11H24N2O/c1-6-7-9(4)13(5)11(14)10(12)8(2)3/h8-10H,6-7,12H2,1-5H3/t9?,10-/m0/s1.
What are the key properties of (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide?
(2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide has a molecular weight of 200.33 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide is sourced from PubChem (CID 61154897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).