N-[(2-methoxyphenyl)methyl]-2-methylpentanamide

C14H21NO2 — CID 2890938

IUPACN-[(2-methoxyphenyl)methyl]-2-methylpentanamide
SMILESCCCC(C)C(=O)NCc1ccccc1OC
InChIInChI=1S/C14H21NO2/c1-4-7-11(2)14(16)15-10-12-8-5-6-9-13(12)17-3/h5-6,8-9,11H,4,7,10H2,1-3H3,(H,15,16)
InChIKeyNFOYMJJWGSYYJL-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.75
Rot. Bonds6

About N-[(2-methoxyphenyl)methyl]-2-methylpentanamide

N-[(2-methoxyphenyl)methyl]-2-methylpentanamide (PubChem CID 2890938) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-methylpentanamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-methylpentanamide
PubChem CID2890938
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-methylpentanamide
SMILESCCCC(C)C(=O)NCc1ccccc1OC
InChIInChI=1S/C14H21NO2/c1-4-7-11(2)14(16)15-10-12-8-5-6-9-13(12)17-3/h5-6,8-9,11H,4,7,10H2,1-3H3,(H,15,16)
InChIKeyNFOYMJJWGSYYJL-UHFFFAOYSA-N
XLogP2.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-methylpentanamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-methylpentanamide (CID 2890938) is N-[(2-methoxyphenyl)methyl]-2-methylpentanamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-methylpentanamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-methylpentanamide is CCCC(C)C(=O)NCc1ccccc1OC.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-methylpentanamide?
The InChIKey is NFOYMJJWGSYYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-7-11(2)14(16)15-10-12-8-5-6-9-13(12)17-3/h5-6,8-9,11H,4,7,10H2,1-3H3,(H,15,16).
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-methylpentanamide?
N-[(2-methoxyphenyl)methyl]-2-methylpentanamide has a molecular weight of 235.33 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-methylpentanamide is sourced from PubChem (CID 2890938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).