N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide

C16H27N3O — CID 61376334

IUPACN-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide
SMILESCNc1ccccc1C(=O)NC(CC(C)C)CN(C)C
InChIInChI=1S/C16H27N3O/c1-12(2)10-13(11-19(4)5)18-16(20)14-8-6-7-9-15(14)17-3/h6-9,12-13,17H,10-11H2,1-5H3,(H,18,20)
InChIKeyQNZGDOZKZLFIFC-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.43
Rot. Bonds7

About N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide

N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide (PubChem CID 61376334) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide
PubChem CID61376334
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide
SMILESCNc1ccccc1C(=O)NC(CC(C)C)CN(C)C
InChIInChI=1S/C16H27N3O/c1-12(2)10-13(11-19(4)5)18-16(20)14-8-6-7-9-15(14)17-3/h6-9,12-13,17H,10-11H2,1-5H3,(H,18,20)
InChIKeyQNZGDOZKZLFIFC-UHFFFAOYSA-N
XLogP2.43
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide 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

2-bromo-N-[1-(dimethylamino)-4-methylpentan-2-yl]benzamide
CID 54877519
N-[1-(dimethylamino)-4-methyl-1-oxopentan-2-yl]-2-(methylamino)benzamide
CID 61376513
2-bromo-N-[1-(dimethylamino)-4-methylpentan-2-yl]pyridine-3-carboxamide
CID 103752619
3-chloro-N-[1-(dimethylamino)-4-methylpentan-2-yl]pyridine-4-carboxamide
CID 66484293
2-(methylamino)-N-(4-methylpentyl)benzamide
CID 61377674
N-[1-(dimethylamino)-4-methylpentan-2-yl]-2,5-dimethylthiophene-3-carboxamide
CID 86994687
N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-hydroxy-5-iodobenzamide
CID 107731679
5-chloro-N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)pyridine-4-carboxamide
CID 114922690
N-methyl-2-(methylamino)-N-(3-methylbutyl)benzamide
CID 61377480
N-[2-(dimethylamino)ethyl]-2-(methylamino)-N-(2-methylpropyl)benzamide
CID 61377482
6-bromo-N-[1-(dimethylamino)-4-methylpentan-2-yl]pyridine-2-carboxamide
CID 103875259
3,5-dibromo-N-[1-(dimethylamino)-4-methylpentan-2-yl]benzamide
CID 107980196

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide?
The IUPAC name of N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide (CID 61376334) is N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide.
What is the SMILES notation for N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide?
The canonical SMILES for N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide is CNc1ccccc1C(=O)NC(CC(C)C)CN(C)C.
What is the InChIKey of N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide?
The InChIKey is QNZGDOZKZLFIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-12(2)10-13(11-19(4)5)18-16(20)14-8-6-7-9-15(14)17-3/h6-9,12-13,17H,10-11H2,1-5H3,(H,18,20).
What are the key properties of N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide?
N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide has a molecular weight of 277.41 g/mol, XLogP of 2.43, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide is sourced from PubChem (CID 61376334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).