2-amino-N-(2-hydroxyethyl)-2-methylpentanamide

C8H18N2O2 — CID 60847863

IUPAC2-amino-N-(2-hydroxyethyl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NCCO
InChIInChI=1S/C8H18N2O2/c1-3-4-8(2,9)7(12)10-5-6-11/h11H,3-6,9H2,1-2H3,(H,10,12)
InChIKeyNQPHTAVKSVVWGD-UHFFFAOYSA-N
MW174.24 g/mol
LogP-0.39
Rot. Bonds5

About 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide

2-amino-N-(2-hydroxyethyl)-2-methylpentanamide (PubChem CID 60847863) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxyethyl)-2-methylpentanamide
PubChem CID60847863
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC Name2-amino-N-(2-hydroxyethyl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NCCO
InChIInChI=1S/C8H18N2O2/c1-3-4-8(2,9)7(12)10-5-6-11/h11H,3-6,9H2,1-2H3,(H,10,12)
InChIKeyNQPHTAVKSVVWGD-UHFFFAOYSA-N
XLogP-0.39
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide?
The IUPAC name of 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide (CID 60847863) is 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide?
The canonical SMILES for 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide is CCCC(C)(N)C(=O)NCCO.
What is the InChIKey of 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide?
The InChIKey is NQPHTAVKSVVWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2/c1-3-4-8(2,9)7(12)10-5-6-11/h11H,3-6,9H2,1-2H3,(H,10,12).
What are the key properties of 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide?
2-amino-N-(2-hydroxyethyl)-2-methylpentanamide has a molecular weight of 174.24 g/mol, XLogP of -0.39, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxyethyl)-2-methylpentanamide is sourced from PubChem (CID 60847863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).