N-pentan-2-ylpentanamide

C10H21NO — CID 4629842

IUPACN-pentan-2-ylpentanamide
SMILESCCCCC(=O)NC(C)CCC
InChIInChI=1S/C10H21NO/c1-4-6-8-10(12)11-9(3)7-5-2/h9H,4-8H2,1-3H3,(H,11,12)
InChIKeyDJHSUFWTUGTEIJ-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.48
Rot. Bonds6

About N-pentan-2-ylpentanamide

N-pentan-2-ylpentanamide (PubChem CID 4629842) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N-pentan-2-ylpentanamide.

Molecular Properties

Compound NameN-pentan-2-ylpentanamide
PubChem CID4629842
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN-pentan-2-ylpentanamide
SMILESCCCCC(=O)NC(C)CCC
InChIInChI=1S/C10H21NO/c1-4-6-8-10(12)11-9(3)7-5-2/h9H,4-8H2,1-3H3,(H,11,12)
InChIKeyDJHSUFWTUGTEIJ-UHFFFAOYSA-N
XLogP2.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-pentan-2-ylpentanamide?
The IUPAC name of N-pentan-2-ylpentanamide (CID 4629842) is N-pentan-2-ylpentanamide.
What is the SMILES notation for N-pentan-2-ylpentanamide?
The canonical SMILES for N-pentan-2-ylpentanamide is CCCCC(=O)NC(C)CCC.
What is the InChIKey of N-pentan-2-ylpentanamide?
The InChIKey is DJHSUFWTUGTEIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-4-6-8-10(12)11-9(3)7-5-2/h9H,4-8H2,1-3H3,(H,11,12).
What are the key properties of N-pentan-2-ylpentanamide?
N-pentan-2-ylpentanamide has a molecular weight of 171.28 g/mol, XLogP of 2.48, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-ylpentanamide is sourced from PubChem (CID 4629842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).