N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide

C20H32N2O2 — CID 86901306

IUPACN-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide
SMILESCC1CN(c2ccccc2NC(=O)CC(C)C(C)(C)C)CC(C)O1
InChIInChI=1S/C20H32N2O2/c1-14(20(4,5)6)11-19(23)21-17-9-7-8-10-18(17)22-12-15(2)24-16(3)13-22/h7-10,14-16H,11-13H2,1-6H3,(H,21,23)
InChIKeyIUFCGVUALOOWRK-UHFFFAOYSA-N
MW332.49 g/mol
LogP4.31
Rot. Bonds4

About N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide

N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide (PubChem CID 86901306) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide
PubChem CID86901306
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC NameN-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide
SMILESCC1CN(c2ccccc2NC(=O)CC(C)C(C)(C)C)CC(C)O1
InChIInChI=1S/C20H32N2O2/c1-14(20(4,5)6)11-19(23)21-17-9-7-8-10-18(17)22-12-15(2)24-16(3)13-22/h7-10,14-16H,11-13H2,1-6H3,(H,21,23)
InChIKeyIUFCGVUALOOWRK-UHFFFAOYSA-N
XLogP4.31
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide 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-(4-hydroxypiperidin-1-yl)phenyl]-3,4,4-trimethylpentanamide
CID 111109805
N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-2-ethylsulfonylacetamide
CID 94469385
N'-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-N-[(2R)-2-hydroxypropyl]oxamide
CID 94444100
1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-3-propylurea
CID 94154582
1-(cyclopropylmethyl)-3-[2-(2,6-dimethylmorpholin-4-yl)phenyl]urea
CID 51085659
1-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-3-(4-hydroxyphenyl)urea
CID 124618726
1-[(2R)-3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]urea
CID 98800991
N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 122134228
N-(2-acetylphenyl)-3,4,4-trimethylpentanamide
CID 63823020
(E)-N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3-phenylprop-2-enamide
CID 60533436
(2S)-N-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-2-methylmorpholine-4-carboxamide
CID 94154647
1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-3-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]urea
CID 124729841

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide?
The IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide (CID 86901306) is N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide?
The canonical SMILES for N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide is CC1CN(c2ccccc2NC(=O)CC(C)C(C)(C)C)CC(C)O1.
What is the InChIKey of N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide?
The InChIKey is IUFCGVUALOOWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-14(20(4,5)6)11-19(23)21-17-9-7-8-10-18(17)22-12-15(2)24-16(3)13-22/h7-10,14-16H,11-13H2,1-6H3,(H,21,23).
What are the key properties of N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide?
N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide has a molecular weight of 332.49 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide is sourced from PubChem (CID 86901306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).