(2S)-2-amino-N,4-dimethylpentanamide

C7H16N2O — CID 11672684

IUPAC(2S)-2-amino-N,4-dimethylpentanamide
SMILESCNC(=O)[C@@H](N)CC(C)C
InChIInChI=1S/C7H16N2O/c1-5(2)4-6(8)7(10)9-3/h5-6H,4,8H2,1-3H3,(H,9,10)/t6-/m0/s1
InChIKeyLIBDTAYIDBPBRN-LURJTMIESA-N
MW144.22 g/mol
LogP0.11
Rot. Bonds3

About (2S)-2-amino-N,4-dimethylpentanamide

(2S)-2-amino-N,4-dimethylpentanamide (PubChem CID 11672684) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is (2S)-2-amino-N,4-dimethylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N,4-dimethylpentanamide
PubChem CID11672684
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name(2S)-2-amino-N,4-dimethylpentanamide
SMILESCNC(=O)[C@@H](N)CC(C)C
InChIInChI=1S/C7H16N2O/c1-5(2)4-6(8)7(10)9-3/h5-6H,4,8H2,1-3H3,(H,9,10)/t6-/m0/s1
InChIKeyLIBDTAYIDBPBRN-LURJTMIESA-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,4-dimethylpentanamide?
The IUPAC name of (2S)-2-amino-N,4-dimethylpentanamide (CID 11672684) is (2S)-2-amino-N,4-dimethylpentanamide.
What is the SMILES notation for (2S)-2-amino-N,4-dimethylpentanamide?
The canonical SMILES for (2S)-2-amino-N,4-dimethylpentanamide is CNC(=O)[C@@H](N)CC(C)C.
What is the InChIKey of (2S)-2-amino-N,4-dimethylpentanamide?
The InChIKey is LIBDTAYIDBPBRN-LURJTMIESA-N. The full InChI is InChI=1S/C7H16N2O/c1-5(2)4-6(8)7(10)9-3/h5-6H,4,8H2,1-3H3,(H,9,10)/t6-/m0/s1.
What are the key properties of (2S)-2-amino-N,4-dimethylpentanamide?
(2S)-2-amino-N,4-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,4-dimethylpentanamide is sourced from PubChem (CID 11672684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).