N,N-diethyl-2-formamidobenzamide

C12H16N2O2 — CID 168652158

IUPACN,N-diethyl-2-formamidobenzamide
SMILESCCN(CC)C(=O)c1ccccc1NC=O
InChIInChI=1S/C12H16N2O2/c1-3-14(4-2)12(16)10-7-5-6-8-11(10)13-9-15/h5-9H,3-4H2,1-2H3,(H,13,15)
InChIKeyJOPMYZPFKBOOLN-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.74
Rot. Bonds5

About N,N-diethyl-2-formamidobenzamide

N,N-diethyl-2-formamidobenzamide (PubChem CID 168652158) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N,N-diethyl-2-formamidobenzamide.

Molecular Properties

Compound NameN,N-diethyl-2-formamidobenzamide
PubChem CID168652158
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN,N-diethyl-2-formamidobenzamide
SMILESCCN(CC)C(=O)c1ccccc1NC=O
InChIInChI=1S/C12H16N2O2/c1-3-14(4-2)12(16)10-7-5-6-8-11(10)13-9-15/h5-9H,3-4H2,1-2H3,(H,13,15)
InChIKeyJOPMYZPFKBOOLN-UHFFFAOYSA-N
XLogP1.74
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(ethenylamino)-N,N-diethylbenzamide
CID 10932915
2-formamido-N,N-dimethylbenzamide
CID 64992505
N,N-diethyl-2-(propylamino)benzamide
CID 62171276
N,N-diethyl-2-(1,2,2-tricyanoethenylamino)benzamide
CID 168609753
N,N-diethyl-2-(naphthalen-1-ylamino)benzamide
CID 86200085
N-ethyl-2-hydrazinyl-N-propylbenzamide
CID 62243548
N,N-diethyl-2-[(4-fluorobenzoyl)amino]benzamide
CID 6458358
N,N-diethyl-2-(2-methylsulfanylpropanoylamino)benzamide
CID 47383171
N-butyl-N-ethyl-2-(methylamino)benzamide
CID 61377458
CID 59369605
CID 59369605
N-ethyl-2-(methylamino)-N-(2-methylbutyl)benzamide
CID 79469822
N,N-diethyl-6-[2-(2-formamidophenyl)ethyl]pyridine-3-carboxamide
CID 20560117

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-formamidobenzamide?
The IUPAC name of N,N-diethyl-2-formamidobenzamide (CID 168652158) is N,N-diethyl-2-formamidobenzamide.
What is the SMILES notation for N,N-diethyl-2-formamidobenzamide?
The canonical SMILES for N,N-diethyl-2-formamidobenzamide is CCN(CC)C(=O)c1ccccc1NC=O.
What is the InChIKey of N,N-diethyl-2-formamidobenzamide?
The InChIKey is JOPMYZPFKBOOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-3-14(4-2)12(16)10-7-5-6-8-11(10)13-9-15/h5-9H,3-4H2,1-2H3,(H,13,15).
What are the key properties of N,N-diethyl-2-formamidobenzamide?
N,N-diethyl-2-formamidobenzamide has a molecular weight of 220.27 g/mol, XLogP of 1.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-formamidobenzamide is sourced from PubChem (CID 168652158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).