N-(2-hydroxyphenyl)-N-methylnitrous amide

C7H8N2O2 — CID 10654399

IUPACN-(2-hydroxyphenyl)-N-methylnitrous amide
SMILESCN(N=O)c1ccccc1O
InChIInChI=1S/C7H8N2O2/c1-9(8-11)6-4-2-3-5-7(6)10/h2-5,10H,1H3
InChIKeyPTOCNKSXDLHDSI-UHFFFAOYSA-N
MW152.15 g/mol
LogP1.51
Rot. Bonds2

About N-(2-hydroxyphenyl)-N-methylnitrous amide

N-(2-hydroxyphenyl)-N-methylnitrous amide (PubChem CID 10654399) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-N-methylnitrous amide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-N-methylnitrous amide
PubChem CID10654399
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC NameN-(2-hydroxyphenyl)-N-methylnitrous amide
SMILESCN(N=O)c1ccccc1O
InChIInChI=1S/C7H8N2O2/c1-9(8-11)6-4-2-3-5-7(6)10/h2-5,10H,1H3
InChIKeyPTOCNKSXDLHDSI-UHFFFAOYSA-N
XLogP1.51
TPSA52.90 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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2-(Piperidin-1-yl)phenol
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(2-Hydroxyphenyl)-dimethyl-prop-2-enylazanium bromide
CID 9816573
But-3-enyl-(2-hydroxyphenyl)-dimethylazanium bromide
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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-N-methylnitrous amide?
The IUPAC name of N-(2-hydroxyphenyl)-N-methylnitrous amide (CID 10654399) is N-(2-hydroxyphenyl)-N-methylnitrous amide.
What is the SMILES notation for N-(2-hydroxyphenyl)-N-methylnitrous amide?
The canonical SMILES for N-(2-hydroxyphenyl)-N-methylnitrous amide is CN(N=O)c1ccccc1O.
What is the InChIKey of N-(2-hydroxyphenyl)-N-methylnitrous amide?
The InChIKey is PTOCNKSXDLHDSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-9(8-11)6-4-2-3-5-7(6)10/h2-5,10H,1H3.
What are the key properties of N-(2-hydroxyphenyl)-N-methylnitrous amide?
N-(2-hydroxyphenyl)-N-methylnitrous amide has a molecular weight of 152.15 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-N-methylnitrous amide is sourced from PubChem (CID 10654399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).