(2R)-2-amino-N-ethyl-N-methylpentanamide

C8H18N2O — CID 93255557

IUPAC(2R)-2-amino-N-ethyl-N-methylpentanamide
SMILESCCC[C@@H](N)C(=O)N(C)CC
InChIInChI=1S/C8H18N2O/c1-4-6-7(9)8(11)10(3)5-2/h7H,4-6,9H2,1-3H3/t7-/m1/s1
InChIKeyDIAOEVGICOMZEO-SSDOTTSWSA-N
MW158.24 g/mol
LogP0.59
Rot. Bonds4

About (2R)-2-amino-N-ethyl-N-methylpentanamide

(2R)-2-amino-N-ethyl-N-methylpentanamide (PubChem CID 93255557) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is (2R)-2-amino-N-ethyl-N-methylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-ethyl-N-methylpentanamide
PubChem CID93255557
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name(2R)-2-amino-N-ethyl-N-methylpentanamide
SMILESCCC[C@@H](N)C(=O)N(C)CC
InChIInChI=1S/C8H18N2O/c1-4-6-7(9)8(11)10(3)5-2/h7H,4-6,9H2,1-3H3/t7-/m1/s1
InChIKeyDIAOEVGICOMZEO-SSDOTTSWSA-N
XLogP0.59
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-ethyl-N-methylpentanamide?
The IUPAC name of (2R)-2-amino-N-ethyl-N-methylpentanamide (CID 93255557) is (2R)-2-amino-N-ethyl-N-methylpentanamide.
What is the SMILES notation for (2R)-2-amino-N-ethyl-N-methylpentanamide?
The canonical SMILES for (2R)-2-amino-N-ethyl-N-methylpentanamide is CCC[C@@H](N)C(=O)N(C)CC.
What is the InChIKey of (2R)-2-amino-N-ethyl-N-methylpentanamide?
The InChIKey is DIAOEVGICOMZEO-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H18N2O/c1-4-6-7(9)8(11)10(3)5-2/h7H,4-6,9H2,1-3H3/t7-/m1/s1.
What are the key properties of (2R)-2-amino-N-ethyl-N-methylpentanamide?
(2R)-2-amino-N-ethyl-N-methylpentanamide has a molecular weight of 158.24 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-ethyl-N-methylpentanamide is sourced from PubChem (CID 93255557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).