(2S)-N,2,4,4-tetramethylpentanamide

C9H19NO — CID 58247049

IUPAC(2S)-N,2,4,4-tetramethylpentanamide
SMILESCNC(=O)[C@@H](C)CC(C)(C)C
InChIInChI=1S/C9H19NO/c1-7(8(11)10-5)6-9(2,3)4/h7H,6H2,1-5H3,(H,10,11)/t7-/m0/s1
InChIKeyLTIFIYVOXMPKLB-ZETCQYMHSA-N
MW157.26 g/mol
LogP1.80
Rot. Bonds2

About (2S)-N,2,4,4-tetramethylpentanamide

(2S)-N,2,4,4-tetramethylpentanamide (PubChem CID 58247049) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (2S)-N,2,4,4-tetramethylpentanamide.

Molecular Properties

Compound Name(2S)-N,2,4,4-tetramethylpentanamide
PubChem CID58247049
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(2S)-N,2,4,4-tetramethylpentanamide
SMILESCNC(=O)[C@@H](C)CC(C)(C)C
InChIInChI=1S/C9H19NO/c1-7(8(11)10-5)6-9(2,3)4/h7H,6H2,1-5H3,(H,10,11)/t7-/m0/s1
InChIKeyLTIFIYVOXMPKLB-ZETCQYMHSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-ethyl-N,3-dimethylpentanamide
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N-methyl-2-propan-2-ylpentanamide
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Cyclopropanecarboxamide, N,2,2,3,3-pentamethyl-
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Frequently Asked Questions

What is the IUPAC name of (2S)-N,2,4,4-tetramethylpentanamide?
The IUPAC name of (2S)-N,2,4,4-tetramethylpentanamide (CID 58247049) is (2S)-N,2,4,4-tetramethylpentanamide.
What is the SMILES notation for (2S)-N,2,4,4-tetramethylpentanamide?
The canonical SMILES for (2S)-N,2,4,4-tetramethylpentanamide is CNC(=O)[C@@H](C)CC(C)(C)C.
What is the InChIKey of (2S)-N,2,4,4-tetramethylpentanamide?
The InChIKey is LTIFIYVOXMPKLB-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H19NO/c1-7(8(11)10-5)6-9(2,3)4/h7H,6H2,1-5H3,(H,10,11)/t7-/m0/s1.
What are the key properties of (2S)-N,2,4,4-tetramethylpentanamide?
(2S)-N,2,4,4-tetramethylpentanamide has a molecular weight of 157.26 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,2,4,4-tetramethylpentanamide is sourced from PubChem (CID 58247049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).