N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide

C15H25N3O — CID 63213540

IUPACN-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide
SMILESCCNc1ccc(C(=O)NCC(C)N(C)C)cc1C
InChIInChI=1S/C15H25N3O/c1-6-16-14-8-7-13(9-11(14)2)15(19)17-10-12(3)18(4)5/h7-9,12,16H,6,10H2,1-5H3,(H,17,19)
InChIKeyRWABODVCLQASQQ-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.11
Rot. Bonds6

About N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide

N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide (PubChem CID 63213540) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide
PubChem CID63213540
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide
SMILESCCNc1ccc(C(=O)NCC(C)N(C)C)cc1C
InChIInChI=1S/C15H25N3O/c1-6-16-14-8-7-13(9-11(14)2)15(19)17-10-12(3)18(4)5/h7-9,12,16H,6,10H2,1-5H3,(H,17,19)
InChIKeyRWABODVCLQASQQ-UHFFFAOYSA-N
XLogP2.11
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)propyl]-2-(ethylamino)-5-methylbenzamide
CID 62508874
4-(ethylamino)-3-methyl-N-(5-methylhexyl)benzamide
CID 115327258
4-(ethylamino)-3-methyl-N-(1-methylcyclopropyl)benzamide
CID 113485970
4-(ethylamino)-3-methyl-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 55163644
4-(ethylamino)-3-methyl-N-pentan-2-ylbenzamide
CID 55161115
3-methyl-4-(propylamino)-N-(2,3,3-trimethylbutyl)benzamide
CID 83145027
4-(ethylamino)-3-methyl-N-(2-methyl-2-methylsulfonylpropyl)benzamide
CID 79558034
4-(ethylamino)-3-methyl-N-[3-(methylamino)-3-oxopropyl]benzamide
CID 63214027
N-[2-(dimethylamino)propyl]-4-hydrazinyl-3-(trifluoromethyl)benzamide
CID 62247665
N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
CID 63209750
4-(ethylamino)-N-[2-(methanesulfonamido)ethyl]-3-methylbenzamide
CID 63210748
4-(ethylamino)-N-(4-methoxybutan-2-yl)-3-methylbenzamide
CID 64605746

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide?
The IUPAC name of N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide (CID 63213540) is N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide.
What is the SMILES notation for N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide?
The canonical SMILES for N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide is CCNc1ccc(C(=O)NCC(C)N(C)C)cc1C.
What is the InChIKey of N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide?
The InChIKey is RWABODVCLQASQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-6-16-14-8-7-13(9-11(14)2)15(19)17-10-12(3)18(4)5/h7-9,12,16H,6,10H2,1-5H3,(H,17,19).
What are the key properties of N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide?
N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide has a molecular weight of 263.38 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide is sourced from PubChem (CID 63213540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).