2-(dimethylamino)-2-pyridin-2-ylpentanamide

C12H19N3O — CID 129053121

IUPAC2-(dimethylamino)-2-pyridin-2-ylpentanamide
SMILESCCCC(C(N)=O)(c1ccccn1)N(C)C
InChIInChI=1S/C12H19N3O/c1-4-8-12(11(13)16,15(2)3)10-7-5-6-9-14-10/h5-7,9H,4,8H2,1-3H3,(H2,13,16)
InChIKeyVBOUKWQFLQGLCZ-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.12
Rot. Bonds5

About 2-(dimethylamino)-2-pyridin-2-ylpentanamide

2-(dimethylamino)-2-pyridin-2-ylpentanamide (PubChem CID 129053121) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-(dimethylamino)-2-pyridin-2-ylpentanamide.

Molecular Properties

Compound Name2-(dimethylamino)-2-pyridin-2-ylpentanamide
PubChem CID129053121
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-(dimethylamino)-2-pyridin-2-ylpentanamide
SMILESCCCC(C(N)=O)(c1ccccn1)N(C)C
InChIInChI=1S/C12H19N3O/c1-4-8-12(11(13)16,15(2)3)10-7-5-6-9-14-10/h5-7,9H,4,8H2,1-3H3,(H2,13,16)
InChIKeyVBOUKWQFLQGLCZ-UHFFFAOYSA-N
XLogP1.12
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-2-pyridin-2-ylpentanamide?
The IUPAC name of 2-(dimethylamino)-2-pyridin-2-ylpentanamide (CID 129053121) is 2-(dimethylamino)-2-pyridin-2-ylpentanamide.
What is the SMILES notation for 2-(dimethylamino)-2-pyridin-2-ylpentanamide?
The canonical SMILES for 2-(dimethylamino)-2-pyridin-2-ylpentanamide is CCCC(C(N)=O)(c1ccccn1)N(C)C.
What is the InChIKey of 2-(dimethylamino)-2-pyridin-2-ylpentanamide?
The InChIKey is VBOUKWQFLQGLCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-8-12(11(13)16,15(2)3)10-7-5-6-9-14-10/h5-7,9H,4,8H2,1-3H3,(H2,13,16).
What are the key properties of 2-(dimethylamino)-2-pyridin-2-ylpentanamide?
2-(dimethylamino)-2-pyridin-2-ylpentanamide has a molecular weight of 221.30 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-2-pyridin-2-ylpentanamide is sourced from PubChem (CID 129053121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).