N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide

C17H27N3O — CID 119613110

IUPACN-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide
SMILESCCCN(CC)c1ccc(C(=O)NC(CN)C2CC2)cc1
InChIInChI=1S/C17H27N3O/c1-3-11-20(4-2)15-9-7-14(8-10-15)17(21)19-16(12-18)13-5-6-13/h7-10,13,16H,3-6,11-12,18H2,1-2H3,(H,19,21)
InChIKeyWGTVSGLQKWMVBP-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.39
Rot. Bonds8

About N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide

N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide (PubChem CID 119613110) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide
PubChem CID119613110
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide
SMILESCCCN(CC)c1ccc(C(=O)NC(CN)C2CC2)cc1
InChIInChI=1S/C17H27N3O/c1-3-11-20(4-2)15-9-7-14(8-10-15)17(21)19-16(12-18)13-5-6-13/h7-10,13,16H,3-6,11-12,18H2,1-2H3,(H,19,21)
InChIKeyWGTVSGLQKWMVBP-UHFFFAOYSA-N
XLogP2.39
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-(2-amino-1-cyclopropylethyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 119616497
1-N-(2-amino-1-cyclopropylethyl)-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
CID 119614508
N-[(2S)-1-aminopropan-2-yl]-4-[butyl(ethyl)amino]benzamide
CID 120505281
N-(2-amino-1-cyclopropylethyl)-4-(propylsulfonylamino)benzamide
CID 119614470
N-(2-amino-1-cyclopropylethyl)-4-(trifluoromethyl)benzamide
CID 65188641
N-(2-amino-1-cyclopropylethyl)-4-methylsulfonylbenzamide;hydrochloride
CID 119617428
N-(2-amino-1-cyclopentylethyl)-4-methylsulfanylbenzamide
CID 106737308
4-[ethyl(propyl)amino]-N-[2-(methylamino)propyl]benzamide
CID 120829950
N-(2-amino-1-cyclopropylethyl)-4-(prop-2-enylsulfamoyl)benzamide
CID 119617561
N-(2-amino-1-cyclopropylethyl)naphthalene-2-carboxamide
CID 65189109
N-(2-amino-1-cyclopropylethyl)-3-fluoro-4-methylbenzamide;hydrochloride
CID 119614951
4-[ethyl(propyl)amino]-N-(2-methylpiperidin-3-yl)benzamide
CID 120573277

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide (CID 119613110) is N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide is CCCN(CC)c1ccc(C(=O)NC(CN)C2CC2)cc1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide?
The InChIKey is WGTVSGLQKWMVBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-3-11-20(4-2)15-9-7-14(8-10-15)17(21)19-16(12-18)13-5-6-13/h7-10,13,16H,3-6,11-12,18H2,1-2H3,(H,19,21).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide?
N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide has a molecular weight of 289.42 g/mol, XLogP of 2.39, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-4-[ethyl(propyl)amino]benzamide is sourced from PubChem (CID 119613110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).