N-methoxy-N-methyl-8-phenylmethoxyoctanamide

C17H27NO3 — CID 169498132

IUPACN-methoxy-N-methyl-8-phenylmethoxyoctanamide
SMILESCON(C)C(=O)CCCCCCCOCc1ccccc1
InChIInChI=1S/C17H27NO3/c1-18(20-2)17(19)13-9-4-3-5-10-14-21-15-16-11-7-6-8-12-16/h6-8,11-12H,3-5,9-10,13-15H2,1-2H3
InChIKeyXLIHISKYMDMSMU-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.56
Rot. Bonds11

About N-methoxy-N-methyl-8-phenylmethoxyoctanamide

N-methoxy-N-methyl-8-phenylmethoxyoctanamide (PubChem CID 169498132) has the molecular formula C17H27NO3 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-methoxy-N-methyl-8-phenylmethoxyoctanamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-8-phenylmethoxyoctanamide
PubChem CID169498132
Molecular FormulaC17H27NO3
Molecular Weight293.41 g/mol
Exact Mass293.20
IUPAC NameN-methoxy-N-methyl-8-phenylmethoxyoctanamide
SMILESCON(C)C(=O)CCCCCCCOCc1ccccc1
InChIInChI=1S/C17H27NO3/c1-18(20-2)17(19)13-9-4-3-5-10-14-21-15-16-11-7-6-8-12-16/h6-8,11-12H,3-5,9-10,13-15H2,1-2H3
InChIKeyXLIHISKYMDMSMU-UHFFFAOYSA-N
XLogP3.56
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl 8-phenylmethoxyoctanoate
CID 562206
benzyl N-[11-[methoxy(methyl)amino]-11-oxoundecyl]carbamate
CID 59544023
CID 162408716
CID 162408716
5-(dibenzylamino)-N-methoxy-N-methylpentanamide
CID 87659903
benzyl (2R)-6-[methoxy(methyl)amino]-2-methyl-6-oxohexanoate
CID 163255717
(2Z)-2-ethylidene-6-phenylmethoxyhexanoic acid
CID 102373802
9-hydroxy-18-phenylmethoxyoctadecanoic acid
CID 101300567
8-methylnon-8-enoxymethylbenzene
CID 10776845
acetic acid;5-phenylmethoxypentan-1-ol
CID 71441282
tert-butyl 10-phenylmethoxy-3-(7-phenylmethoxyheptyl)dec-2-enoate
CID 177188889
N-methyl-4-phenylmethoxy-N-[(1S)-1-pyridin-4-ylethyl]butanamide
CID 94347343
5-[2-(5-phenylmethoxypentoxy)ethoxy]pentoxymethylbenzene
CID 135358353

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-8-phenylmethoxyoctanamide?
The IUPAC name of N-methoxy-N-methyl-8-phenylmethoxyoctanamide (CID 169498132) is N-methoxy-N-methyl-8-phenylmethoxyoctanamide.
What is the SMILES notation for N-methoxy-N-methyl-8-phenylmethoxyoctanamide?
The canonical SMILES for N-methoxy-N-methyl-8-phenylmethoxyoctanamide is CON(C)C(=O)CCCCCCCOCc1ccccc1.
What is the InChIKey of N-methoxy-N-methyl-8-phenylmethoxyoctanamide?
The InChIKey is XLIHISKYMDMSMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO3/c1-18(20-2)17(19)13-9-4-3-5-10-14-21-15-16-11-7-6-8-12-16/h6-8,11-12H,3-5,9-10,13-15H2,1-2H3.
What are the key properties of N-methoxy-N-methyl-8-phenylmethoxyoctanamide?
N-methoxy-N-methyl-8-phenylmethoxyoctanamide has a molecular weight of 293.41 g/mol, XLogP of 3.56, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-8-phenylmethoxyoctanamide is sourced from PubChem (CID 169498132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).