N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide

C11H25N3O — CID 61275240

IUPACN-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NCC(CC(C)C)N(C)C
InChIInChI=1S/C11H25N3O/c1-9(2)6-10(14(4)5)7-13-11(15)8-12-3/h9-10,12H,6-8H2,1-5H3,(H,13,15)
InChIKeyJYGCAOFILRGXRX-UHFFFAOYSA-N
MW215.34 g/mol
LogP0.30
Rot. Bonds7

About N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide

N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide (PubChem CID 61275240) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide
PubChem CID61275240
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC NameN-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NCC(CC(C)C)N(C)C
InChIInChI=1S/C11H25N3O/c1-9(2)6-10(14(4)5)7-13-11(15)8-12-3/h9-10,12H,6-8H2,1-5H3,(H,13,15)
InChIKeyJYGCAOFILRGXRX-UHFFFAOYSA-N
XLogP0.30
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide?
The IUPAC name of N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide (CID 61275240) is N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide?
The canonical SMILES for N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide is CNCC(=O)NCC(CC(C)C)N(C)C.
What is the InChIKey of N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide?
The InChIKey is JYGCAOFILRGXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-9(2)6-10(14(4)5)7-13-11(15)8-12-3/h9-10,12H,6-8H2,1-5H3,(H,13,15).
What are the key properties of N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide?
N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide has a molecular weight of 215.34 g/mol, XLogP of 0.30, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide is sourced from PubChem (CID 61275240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).