N-[ethoxy(phenyl)methyl]formamide

C10H13NO2 — CID 24975232

IUPACN-[ethoxy(phenyl)methyl]formamide
SMILESCCOC(NC=O)c1ccccc1
InChIInChI=1S/C10H13NO2/c1-2-13-10(11-8-12)9-6-4-3-5-7-9/h3-8,10H,2H2,1H3,(H,11,12)
InChIKeyGZXYYGWZENEZGN-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.47
Rot. Bonds5

About N-[ethoxy(phenyl)methyl]formamide

N-[ethoxy(phenyl)methyl]formamide (PubChem CID 24975232) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is N-[ethoxy(phenyl)methyl]formamide.

Molecular Properties

Compound NameN-[ethoxy(phenyl)methyl]formamide
PubChem CID24975232
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC NameN-[ethoxy(phenyl)methyl]formamide
SMILESCCOC(NC=O)c1ccccc1
InChIInChI=1S/C10H13NO2/c1-2-13-10(11-8-12)9-6-4-3-5-7-9/h3-8,10H,2H2,1H3,(H,11,12)
InChIKeyGZXYYGWZENEZGN-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N-[ethoxy(phenyl)methyl]formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,3-diethoxy-2-phenylpropanal
CID 174566751
ethyl N-[(R)-ethoxy(phenyl)methyl]carbamate
CID 7315555
N-[ethoxy(phenyl)methyl]prop-2-en-1-amine;hydrochloride
CID 175308100
N-benzhydrylformamide;diphenylmethanamine;ethyl formate
CID 158977505
N-benzhydrylformamide;diphenylmethanamine;ethyl formate;methane
CID 160841595
N-(2,2-diethoxyethyl)-2,2-diphenylethanamine
CID 70269046
ethyl 2-amino-2-phenylacetate;ethyl 2-formamido-2-phenylacetate;hydrochloride
CID 158687783
N-[(1S,2S)-1-[(2S)-1,1-diethoxy-3-nitropropan-2-yl]oxy-1-phenylpropan-2-yl]formamide
CID 134999620
(1-ethoxy-1-phenylbut-3-en-2-yl)hydrazine
CID 105279224
N-(1,3-dihydroxy-1-phenylpropan-2-yl)formamide
CID 13382275
N-[(1S,2S)-1,3-dihydroxy-1-phenylpropan-2-yl]formamide
CID 13382276
methanol;methoxymethane;N-(2-oxo-1-phenylethyl)formamide
CID 155715793

Frequently Asked Questions

What is the IUPAC name of N-[ethoxy(phenyl)methyl]formamide?
The IUPAC name of N-[ethoxy(phenyl)methyl]formamide (CID 24975232) is N-[ethoxy(phenyl)methyl]formamide.
What is the SMILES notation for N-[ethoxy(phenyl)methyl]formamide?
The canonical SMILES for N-[ethoxy(phenyl)methyl]formamide is CCOC(NC=O)c1ccccc1.
What is the InChIKey of N-[ethoxy(phenyl)methyl]formamide?
The InChIKey is GZXYYGWZENEZGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-2-13-10(11-8-12)9-6-4-3-5-7-9/h3-8,10H,2H2,1H3,(H,11,12).
What are the key properties of N-[ethoxy(phenyl)methyl]formamide?
N-[ethoxy(phenyl)methyl]formamide has a molecular weight of 179.22 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[ethoxy(phenyl)methyl]formamide is sourced from PubChem (CID 24975232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).