N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide

C15H24N2O2 — CID 102978926

IUPACN-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide
SMILESCCN(CCCN(C)C)C(=O)c1cccc(O)c1C
InChIInChI=1S/C15H24N2O2/c1-5-17(11-7-10-16(3)4)15(19)13-8-6-9-14(18)12(13)2/h6,8-9,18H,5,7,10-11H2,1-4H3
InChIKeyYLKVXTXBYTXONA-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.11
Rot. Bonds6

About N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide

N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide (PubChem CID 102978926) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide
PubChem CID102978926
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide
SMILESCCN(CCCN(C)C)C(=O)c1cccc(O)c1C
InChIInChI=1S/C15H24N2O2/c1-5-17(11-7-10-16(3)4)15(19)13-8-6-9-14(18)12(13)2/h6,8-9,18H,5,7,10-11H2,1-4H3
InChIKeyYLKVXTXBYTXONA-UHFFFAOYSA-N
XLogP2.11
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide 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-[2-(dimethylamino)ethyl]-3-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 82829732
N-ethyl-3-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 82830028
N-ethyl-3-hydroxy-N-(2-hydroxy-2-methylpropyl)-2-methylbenzamide
CID 82829511
N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide
CID 82829503
N-[3-(diethylamino)propyl]-N-ethyl-2,3-dihydroxybenzamide
CID 102993947
3-bromo-N-[3-(diethylamino)propyl]-N-ethyl-2-methylbenzamide
CID 102993518
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-hydroxy-2-methylbenzamide
CID 82795366
3-amino-N-[3-(dimethylamino)propyl]-2-ethoxy-N-ethylbenzamide
CID 102990804
N-[3-(dimethylamino)propyl]-N-ethyl-3,4-dihydroxybenzamide
CID 102978865
N-[(4-aminophenyl)methyl]-N-ethyl-3-hydroxy-2-methylbenzamide
CID 82809597
N,N-diethyl-2,3-dihydroxybenzamide
CID 15178612
N-ethyl-2,6-dihydroxy-N-(3-hydroxypropyl)benzamide
CID 107689617

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide (CID 102978926) is N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide is CCN(CCCN(C)C)C(=O)c1cccc(O)c1C.
What is the InChIKey of N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide?
The InChIKey is YLKVXTXBYTXONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-17(11-7-10-16(3)4)15(19)13-8-6-9-14(18)12(13)2/h6,8-9,18H,5,7,10-11H2,1-4H3.
What are the key properties of N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide?
N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide has a molecular weight of 264.37 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide is sourced from PubChem (CID 102978926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).