N-ethyl-3-(2-methylpropylamino)benzamide

C13H20N2O — CID 43680721

IUPACN-ethyl-3-(2-methylpropylamino)benzamide
SMILESCCNC(=O)c1cccc(NCC(C)C)c1
InChIInChI=1S/C13H20N2O/c1-4-14-13(16)11-6-5-7-12(8-11)15-9-10(2)3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16)
InChIKeyMUCFVXOZQNLZAU-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.50
Rot. Bonds5

About N-ethyl-3-(2-methylpropylamino)benzamide

N-ethyl-3-(2-methylpropylamino)benzamide (PubChem CID 43680721) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-ethyl-3-(2-methylpropylamino)benzamide.

Molecular Properties

Compound NameN-ethyl-3-(2-methylpropylamino)benzamide
PubChem CID43680721
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-ethyl-3-(2-methylpropylamino)benzamide
SMILESCCNC(=O)c1cccc(NCC(C)C)c1
InChIInChI=1S/C13H20N2O/c1-4-14-13(16)11-6-5-7-12(8-11)15-9-10(2)3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16)
InChIKeyMUCFVXOZQNLZAU-UHFFFAOYSA-N
XLogP2.50
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-ethyl-3-(2-methylpropylamino)benzamide 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

N-ethyl-3-(2-methylpentylamino)benzamide
CID 43680679
N-ethyl-3-(2-methylpropylcarbamoylamino)benzamide
CID 47200674
N-ethyl-3-(prop-2-ynylamino)benzamide
CID 60681699
3-acetamido-N-ethylbenzamide
CID 17230670
3-(ethylamino)-N-propylbenzamide
CID 43676038
N-(2-methylpropyl)-3-(pyridin-4-ylmethylamino)benzamide
CID 17057983
1-N,3-N-bis(2-methylpropyl)benzene-1,3-diamine
CID 86210277
N-ethyl-3-(pyrimidin-5-ylmethylamino)benzamide
CID 62758960
N-ethyl-3-(1-thiophen-3-ylethylamino)benzamide
CID 55032381
3-[(5-bromothiophen-3-yl)methylamino]-N-ethylbenzamide
CID 43680774
methyl 4-[[3-(ethylcarbamoyl)phenyl]carbamoyl]benzoate
CID 17230817
3-[1-(4-bromothiophen-2-yl)ethylamino]-N-ethylbenzamide
CID 107167773

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-methylpropylamino)benzamide?
The IUPAC name of N-ethyl-3-(2-methylpropylamino)benzamide (CID 43680721) is N-ethyl-3-(2-methylpropylamino)benzamide.
What is the SMILES notation for N-ethyl-3-(2-methylpropylamino)benzamide?
The canonical SMILES for N-ethyl-3-(2-methylpropylamino)benzamide is CCNC(=O)c1cccc(NCC(C)C)c1.
What is the InChIKey of N-ethyl-3-(2-methylpropylamino)benzamide?
The InChIKey is MUCFVXOZQNLZAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-14-13(16)11-6-5-7-12(8-11)15-9-10(2)3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16).
What are the key properties of N-ethyl-3-(2-methylpropylamino)benzamide?
N-ethyl-3-(2-methylpropylamino)benzamide has a molecular weight of 220.32 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-methylpropylamino)benzamide is sourced from PubChem (CID 43680721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).