(2S)-2-amino-N,3-dimethylpentanamide

C7H16N2O — CID 58604647

IUPAC(2S)-2-amino-N,3-dimethylpentanamide
SMILESCCC(C)[C@H](N)C(=O)NC
InChIInChI=1S/C7H16N2O/c1-4-5(2)6(8)7(10)9-3/h5-6H,4,8H2,1-3H3,(H,9,10)/t5?,6-/m0/s1
InChIKeyPCWZFJQSFIEREL-GDVGLLTNSA-N
MW144.22 g/mol
LogP0.11
Rot. Bonds3

About (2S)-2-amino-N,3-dimethylpentanamide

(2S)-2-amino-N,3-dimethylpentanamide (PubChem CID 58604647) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is (2S)-2-amino-N,3-dimethylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N,3-dimethylpentanamide
PubChem CID58604647
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name(2S)-2-amino-N,3-dimethylpentanamide
SMILESCCC(C)[C@H](N)C(=O)NC
InChIInChI=1S/C7H16N2O/c1-4-5(2)6(8)7(10)9-3/h5-6H,4,8H2,1-3H3,(H,9,10)/t5?,6-/m0/s1
InChIKeyPCWZFJQSFIEREL-GDVGLLTNSA-N
XLogP0.11
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N,3-dimethylpentanamide?
The IUPAC name of (2S)-2-amino-N,3-dimethylpentanamide (CID 58604647) is (2S)-2-amino-N,3-dimethylpentanamide.
What is the SMILES notation for (2S)-2-amino-N,3-dimethylpentanamide?
The canonical SMILES for (2S)-2-amino-N,3-dimethylpentanamide is CCC(C)[C@H](N)C(=O)NC.
What is the InChIKey of (2S)-2-amino-N,3-dimethylpentanamide?
The InChIKey is PCWZFJQSFIEREL-GDVGLLTNSA-N. The full InChI is InChI=1S/C7H16N2O/c1-4-5(2)6(8)7(10)9-3/h5-6H,4,8H2,1-3H3,(H,9,10)/t5?,6-/m0/s1.
What are the key properties of (2S)-2-amino-N,3-dimethylpentanamide?
(2S)-2-amino-N,3-dimethylpentanamide has a molecular weight of 144.22 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N,3-dimethylpentanamide is sourced from PubChem (CID 58604647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).