N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide

C17H29N3O — CID 103188613

IUPACN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide
SMILESCCN(C(=O)c1ccccc1CCNC)C(C)CN(C)C
InChIInChI=1S/C17H29N3O/c1-6-20(14(2)13-19(4)5)17(21)16-10-8-7-9-15(16)11-12-18-3/h7-10,14,18H,6,11-13H2,1-5H3
InChIKeyIMCZRYQYXCCOEI-UHFFFAOYSA-N
MW291.44 g/mol
LogP1.86
Rot. Bonds8

About N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide

N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide (PubChem CID 103188613) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide
PubChem CID103188613
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide
SMILESCCN(C(=O)c1ccccc1CCNC)C(C)CN(C)C
InChIInChI=1S/C17H29N3O/c1-6-20(14(2)13-19(4)5)17(21)16-10-8-7-9-15(16)11-12-18-3/h7-10,14,18H,6,11-13H2,1-5H3
InChIKeyIMCZRYQYXCCOEI-UHFFFAOYSA-N
XLogP1.86
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-2-[2-(methylamino)ethyl]benzamide
CID 104547231
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-(ethylamino)benzamide
CID 103190086
2-[methyl-[2-[2-(methylamino)ethyl]benzoyl]amino]propanoic acid
CID 104547839
N-methyl-N,2-bis[2-(methylamino)ethyl]benzamide
CID 104547950
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-(methylamino)pyridine-3-carboxamide
CID 103191074
N-methoxy-N-methyl-2-[2-(methylamino)ethyl]benzamide
CID 104547715
2-methyl-1-[2-[2-(methylamino)ethyl]phenyl]butan-1-one
CID 116613172
N-ethyl-N-(2-hydroxyethyl)-2-[2-(methylamino)ethyl]benzamide
CID 104547574
3-methyl-1-[2-[2-(methylamino)ethyl]phenyl]butan-1-one
CID 116613183
N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide
CID 113425674
N-methyl-2-[2-(methylamino)ethyl]-N-[3-(methylamino)propyl]benzamide
CID 104548124
2-(3-aminoprop-1-ynyl)-N-[1-(dimethylamino)propan-2-yl]-N-ethylbenzamide
CID 103190523

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide?
The IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide (CID 103188613) is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide.
What is the SMILES notation for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide?
The canonical SMILES for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide is CCN(C(=O)c1ccccc1CCNC)C(C)CN(C)C.
What is the InChIKey of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide?
The InChIKey is IMCZRYQYXCCOEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-6-20(14(2)13-19(4)5)17(21)16-10-8-7-9-15(16)11-12-18-3/h7-10,14,18H,6,11-13H2,1-5H3.
What are the key properties of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide?
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide has a molecular weight of 291.44 g/mol, XLogP of 1.86, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-[2-(methylamino)ethyl]benzamide is sourced from PubChem (CID 103188613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).