N-methyl-N-(2-propylpentyl)acetamide

C11H23NO — CID 3040954

IUPACN-methyl-N-(2-propylpentyl)acetamide
SMILESCCCC(CCC)CN(C)C(C)=O
InChIInChI=1S/C11H23NO/c1-5-7-11(8-6-2)9-12(4)10(3)13/h11H,5-9H2,1-4H3
InChIKeyPDOAUJDOLCJNBR-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.68
Rot. Bonds6

About N-methyl-N-(2-propylpentyl)acetamide

N-methyl-N-(2-propylpentyl)acetamide (PubChem CID 3040954) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-methyl-N-(2-propylpentyl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(2-propylpentyl)acetamide
PubChem CID3040954
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-methyl-N-(2-propylpentyl)acetamide
SMILESCCCC(CCC)CN(C)C(C)=O
InChIInChI=1S/C11H23NO/c1-5-7-11(8-6-2)9-12(4)10(3)13/h11H,5-9H2,1-4H3
InChIKeyPDOAUJDOLCJNBR-UHFFFAOYSA-N
XLogP2.68
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-propylpentyl)acetamide?
The IUPAC name of N-methyl-N-(2-propylpentyl)acetamide (CID 3040954) is N-methyl-N-(2-propylpentyl)acetamide.
What is the SMILES notation for N-methyl-N-(2-propylpentyl)acetamide?
The canonical SMILES for N-methyl-N-(2-propylpentyl)acetamide is CCCC(CCC)CN(C)C(C)=O.
What is the InChIKey of N-methyl-N-(2-propylpentyl)acetamide?
The InChIKey is PDOAUJDOLCJNBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-5-7-11(8-6-2)9-12(4)10(3)13/h11H,5-9H2,1-4H3.
What are the key properties of N-methyl-N-(2-propylpentyl)acetamide?
N-methyl-N-(2-propylpentyl)acetamide has a molecular weight of 185.31 g/mol, XLogP of 2.68, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-propylpentyl)acetamide is sourced from PubChem (CID 3040954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).