N-butan-2-ylpentanamide

C9H19NO — CID 5147467

IUPACN-butan-2-ylpentanamide
SMILESCCCCC(=O)NC(C)CC
InChIInChI=1S/C9H19NO/c1-4-6-7-9(11)10-8(3)5-2/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyRENKTLOWGLYTEK-UHFFFAOYSA-N
MW157.26 g/mol
LogP2.09
Rot. Bonds5

About N-butan-2-ylpentanamide

N-butan-2-ylpentanamide (PubChem CID 5147467) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-butan-2-ylpentanamide.

Molecular Properties

Compound NameN-butan-2-ylpentanamide
PubChem CID5147467
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-butan-2-ylpentanamide
SMILESCCCCC(=O)NC(C)CC
InChIInChI=1S/C9H19NO/c1-4-6-7-9(11)10-8(3)5-2/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyRENKTLOWGLYTEK-UHFFFAOYSA-N
XLogP2.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-ylpentanamide?
The IUPAC name of N-butan-2-ylpentanamide (CID 5147467) is N-butan-2-ylpentanamide.
What is the SMILES notation for N-butan-2-ylpentanamide?
The canonical SMILES for N-butan-2-ylpentanamide is CCCCC(=O)NC(C)CC.
What is the InChIKey of N-butan-2-ylpentanamide?
The InChIKey is RENKTLOWGLYTEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-4-6-7-9(11)10-8(3)5-2/h8H,4-7H2,1-3H3,(H,10,11).
What are the key properties of N-butan-2-ylpentanamide?
N-butan-2-ylpentanamide has a molecular weight of 157.26 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-ylpentanamide is sourced from PubChem (CID 5147467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).