N-(4-aminophenyl)-N-methylformamide

C8H10N2O — CID 19983561

IUPACN-(4-aminophenyl)-N-methylformamide
SMILESCN(C=O)c1ccc(N)cc1
InChIInChI=1S/C8H10N2O/c1-10(6-11)8-4-2-7(9)3-5-8/h2-6H,9H2,1H3
InChIKeyUSTMJTINOLXGCI-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.86
Rot. Bonds2

About N-(4-aminophenyl)-N-methylformamide

N-(4-aminophenyl)-N-methylformamide (PubChem CID 19983561) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is N-(4-aminophenyl)-N-methylformamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-N-methylformamide
PubChem CID19983561
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC NameN-(4-aminophenyl)-N-methylformamide
SMILESCN(C=O)c1ccc(N)cc1
InChIInChI=1S/C8H10N2O/c1-10(6-11)8-4-2-7(9)3-5-8/h2-6H,9H2,1H3
InChIKeyUSTMJTINOLXGCI-UHFFFAOYSA-N
XLogP0.86
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-N-methylformamide?
The IUPAC name of N-(4-aminophenyl)-N-methylformamide (CID 19983561) is N-(4-aminophenyl)-N-methylformamide.
What is the SMILES notation for N-(4-aminophenyl)-N-methylformamide?
The canonical SMILES for N-(4-aminophenyl)-N-methylformamide is CN(C=O)c1ccc(N)cc1.
What is the InChIKey of N-(4-aminophenyl)-N-methylformamide?
The InChIKey is USTMJTINOLXGCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-10(6-11)8-4-2-7(9)3-5-8/h2-6H,9H2,1H3.
What are the key properties of N-(4-aminophenyl)-N-methylformamide?
N-(4-aminophenyl)-N-methylformamide has a molecular weight of 150.18 g/mol, XLogP of 0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-N-methylformamide is sourced from PubChem (CID 19983561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).