2-amino-N-ethyl-5-methyl-N-propylbenzamide

C13H20N2O — CID 62511065

IUPAC2-amino-N-ethyl-5-methyl-N-propylbenzamide
SMILESCCCN(CC)C(=O)c1cc(C)ccc1N
InChIInChI=1S/C13H20N2O/c1-4-8-15(5-2)13(16)11-9-10(3)6-7-12(11)14/h6-7,9H,4-5,8,14H2,1-3H3
InChIKeyUYLPMLXDGDDWDP-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.45
Rot. Bonds4

About 2-amino-N-ethyl-5-methyl-N-propylbenzamide

2-amino-N-ethyl-5-methyl-N-propylbenzamide (PubChem CID 62511065) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-amino-N-ethyl-5-methyl-N-propylbenzamide.

Molecular Properties

Compound Name2-amino-N-ethyl-5-methyl-N-propylbenzamide
PubChem CID62511065
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-amino-N-ethyl-5-methyl-N-propylbenzamide
SMILESCCCN(CC)C(=O)c1cc(C)ccc1N
InChIInChI=1S/C13H20N2O/c1-4-8-15(5-2)13(16)11-9-10(3)6-7-12(11)14/h6-7,9H,4-5,8,14H2,1-3H3
InChIKeyUYLPMLXDGDDWDP-UHFFFAOYSA-N
XLogP2.45
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-methyl-N,N-dipropylbenzamide
CID 62073624
2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methylbenzamide
CID 63690620
N-ethyl-2-fluoro-4-methyl-N-propylbenzamide
CID 79779356
N,N-diethyl-2,5-dimethylbenzamide
CID 15621070
2-amino-N,N-bis(cyanomethyl)-5-methylbenzamide
CID 62508953
2-bromo-N-[2-(dimethylamino)ethyl]-5-methyl-N-propylbenzamide
CID 81005126
2-amino-N-[2-[(4-cyano-2-pyridinyl)-methylamino]ethyl]-N-ethyl-5-methylbenzamide
CID 145106409
2-methoxy-5-methyl-N,N-dipropylbenzamide
CID 110761077
2-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-5-methylbenzamide
CID 107477906
N-(2-bromoethyl)-N-ethyl-2,4-dimethylbenzamide
CID 80661347
5-methyl-2-(methylamino)-N,N-dipropylbenzamide
CID 55082842
N-[2-(dimethylamino)ethyl]-2-fluoro-4-methyl-N-propylbenzamide
CID 79796018

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-5-methyl-N-propylbenzamide?
The IUPAC name of 2-amino-N-ethyl-5-methyl-N-propylbenzamide (CID 62511065) is 2-amino-N-ethyl-5-methyl-N-propylbenzamide.
What is the SMILES notation for 2-amino-N-ethyl-5-methyl-N-propylbenzamide?
The canonical SMILES for 2-amino-N-ethyl-5-methyl-N-propylbenzamide is CCCN(CC)C(=O)c1cc(C)ccc1N.
What is the InChIKey of 2-amino-N-ethyl-5-methyl-N-propylbenzamide?
The InChIKey is UYLPMLXDGDDWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-8-15(5-2)13(16)11-9-10(3)6-7-12(11)14/h6-7,9H,4-5,8,14H2,1-3H3.
What are the key properties of 2-amino-N-ethyl-5-methyl-N-propylbenzamide?
2-amino-N-ethyl-5-methyl-N-propylbenzamide has a molecular weight of 220.32 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-5-methyl-N-propylbenzamide is sourced from PubChem (CID 62511065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).