N-methyl-2-propan-2-ylpentanamide

C9H19NO — CID 44550486

IUPACN-methyl-2-propan-2-ylpentanamide
SMILESCCCC(C(=O)NC)C(C)C
InChIInChI=1S/C9H19NO/c1-5-6-8(7(2)3)9(11)10-4/h7-8H,5-6H2,1-4H3,(H,10,11)
InChIKeyJCTKCAKUPTVEEK-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.80
Rot. Bonds4

About N-methyl-2-propan-2-ylpentanamide

N-methyl-2-propan-2-ylpentanamide (PubChem CID 44550486) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-methyl-2-propan-2-ylpentanamide.

Molecular Properties

Compound NameN-methyl-2-propan-2-ylpentanamide
PubChem CID44550486
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-methyl-2-propan-2-ylpentanamide
SMILESCCCC(C(=O)NC)C(C)C
InChIInChI=1S/C9H19NO/c1-5-6-8(7(2)3)9(11)10-4/h7-8H,5-6H2,1-4H3,(H,10,11)
InChIKeyJCTKCAKUPTVEEK-UHFFFAOYSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-propan-2-ylpentanamide?
The IUPAC name of N-methyl-2-propan-2-ylpentanamide (CID 44550486) is N-methyl-2-propan-2-ylpentanamide.
What is the SMILES notation for N-methyl-2-propan-2-ylpentanamide?
The canonical SMILES for N-methyl-2-propan-2-ylpentanamide is CCCC(C(=O)NC)C(C)C.
What is the InChIKey of N-methyl-2-propan-2-ylpentanamide?
The InChIKey is JCTKCAKUPTVEEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-5-6-8(7(2)3)9(11)10-4/h7-8H,5-6H2,1-4H3,(H,10,11).
What are the key properties of N-methyl-2-propan-2-ylpentanamide?
N-methyl-2-propan-2-ylpentanamide has a molecular weight of 157.26 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-propan-2-ylpentanamide is sourced from PubChem (CID 44550486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).