N-methyl-N-phenylmethoxyformamide

C9H11NO2 — CID 57089495

IUPACN-methyl-N-phenylmethoxyformamide
SMILESCN(C=O)OCc1ccccc1
InChIInChI=1S/C9H11NO2/c1-10(8-11)12-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChIKeyKBWXVSWRMQDDDO-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.21
Rot. Bonds4

About N-methyl-N-phenylmethoxyformamide

N-methyl-N-phenylmethoxyformamide (PubChem CID 57089495) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is N-methyl-N-phenylmethoxyformamide.

Molecular Properties

Compound NameN-methyl-N-phenylmethoxyformamide
PubChem CID57089495
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC NameN-methyl-N-phenylmethoxyformamide
SMILESCN(C=O)OCc1ccccc1
InChIInChI=1S/C9H11NO2/c1-10(8-11)12-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChIKeyKBWXVSWRMQDDDO-UHFFFAOYSA-N
XLogP1.21
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-ethylphenyl)-N-phenylmethoxyformamide
CID 174380658
N-pentyl-N-phenylmethoxyformamide
CID 88956477
(2S)-2-[formyl(phenylmethoxy)amino]-3-methylbutanoic acid
CID 174326736
N-cyclopentyl-N-phenylmethoxyformamide
CID 174570352
N-(4-hydroxybutyl)-N-phenylmethoxyformamide
CID 87139283
N,N-dimethylmethanamine;2-phenylacetaldehyde
CID 87974312
[bis(trimethylsilyl)amino]oxymethylbenzene
CID 556622
N-hydroxy-N-phenylmethoxyacetamide
CID 173249339
N-phenylmethoxyacetohydrazide
CID 174450270
N-(3-oxopropyl)-N-phenylmethoxyacetamide
CID 71545702
N-(8-hydroxyoctyl)-N-phenylmethoxyformamide
CID 57042155
2-[[formyl(phenylmethoxy)amino]methyl]-4-methylpentanoic acid
CID 19367512

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenylmethoxyformamide?
The IUPAC name of N-methyl-N-phenylmethoxyformamide (CID 57089495) is N-methyl-N-phenylmethoxyformamide.
What is the SMILES notation for N-methyl-N-phenylmethoxyformamide?
The canonical SMILES for N-methyl-N-phenylmethoxyformamide is CN(C=O)OCc1ccccc1.
What is the InChIKey of N-methyl-N-phenylmethoxyformamide?
The InChIKey is KBWXVSWRMQDDDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-10(8-11)12-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3.
What are the key properties of N-methyl-N-phenylmethoxyformamide?
N-methyl-N-phenylmethoxyformamide has a molecular weight of 165.19 g/mol, XLogP of 1.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenylmethoxyformamide is sourced from PubChem (CID 57089495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).