(2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide

C11H24N2O — CID 79024707

IUPAC(2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide
SMILESCC[C@H](N)C(=O)N(CC(C)C)C(C)C
InChIInChI=1S/C11H24N2O/c1-6-10(12)11(14)13(9(4)5)7-8(2)3/h8-10H,6-7,12H2,1-5H3/t10-/m0/s1
InChIKeyCLESEHQKEODFSC-JTQLQIEISA-N
MW200.33 g/mol
LogP1.62
Rot. Bonds5

About (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide

(2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide (PubChem CID 79024707) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide
PubChem CID79024707
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name(2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide
SMILESCC[C@H](N)C(=O)N(CC(C)C)C(C)C
InChIInChI=1S/C11H24N2O/c1-6-10(12)11(14)13(9(4)5)7-8(2)3/h8-10H,6-7,12H2,1-5H3/t10-/m0/s1
InChIKeyCLESEHQKEODFSC-JTQLQIEISA-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

(2R)-2-amino-N-(2-methylpropyl)-4-methylsulfanyl-N-propan-2-ylbutanamide
CID 104907733
(2S)-2-amino-N-propan-2-yl-N-(2,2,2-trifluoroethyl)butanamide
CID 79024502
(2R)-2-amino-N-(2-methoxyethyl)-N-propan-2-ylbutanamide
CID 82949069
3-amino-4-[2-methylpropyl(pentan-3-yl)amino]-4-oxobutanoic acid
CID 79490276
3-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide
CID 60946125
(2S)-2-amino-3-(3,4-dihydroxyphenyl)-N-(2-methylpropyl)-N-propan-2-ylpropanamide
CID 61163930
2-amino-N,N-dimethylbutanamide
CID 43649466
(2S,3S)-2-amino-3-methyl-N-(2-methylpropyl)-N-pentan-3-ylpentanamide
CID 79491812
N-(2-methylpropyl)-N-propan-2-ylcarbamoyl chloride
CID 79886811
(2R)-2-amino-3,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylbutanamide
CID 103930183
(2R)-2-amino-N-butan-2-yl-N-ethyl-4-methylpentanamide
CID 104902610
(2S)-2-amino-N-ethyl-N-propan-2-ylpropanamide
CID 61145665

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide?
The IUPAC name of (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide (CID 79024707) is (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide.
What is the SMILES notation for (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide?
The canonical SMILES for (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide is CC[C@H](N)C(=O)N(CC(C)C)C(C)C.
What is the InChIKey of (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide?
The InChIKey is CLESEHQKEODFSC-JTQLQIEISA-N. The full InChI is InChI=1S/C11H24N2O/c1-6-10(12)11(14)13(9(4)5)7-8(2)3/h8-10H,6-7,12H2,1-5H3/t10-/m0/s1.
What are the key properties of (2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide?
(2S)-2-amino-N-(2-methylpropyl)-N-propan-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-(2-methylpropyl)-N-propan-2-ylbutanamide is sourced from PubChem (CID 79024707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).