N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide

C23H31N3O2 — CID 43036311

IUPACN-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide
SMILESCc1cccc(C)c1NC(=O)C(C)NCc1ccccc1CN1CCOCC1
InChIInChI=1S/C23H31N3O2/c1-17-7-6-8-18(2)22(17)25-23(27)19(3)24-15-20-9-4-5-10-21(20)16-26-11-13-28-14-12-26/h4-10,19,24H,11-16H2,1-3H3,(H,25,27)
InChIKeyLETVDGMVEPVXNA-UHFFFAOYSA-N
MW381.52 g/mol
LogP3.25
Rot. Bonds7

About N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide

N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide (PubChem CID 43036311) has the molecular formula C23H31N3O2 and a molecular weight of 381.52 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide
PubChem CID43036311
Molecular FormulaC23H31N3O2
Molecular Weight381.52 g/mol
Exact Mass381.24
IUPAC NameN-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide
SMILESCc1cccc(C)c1NC(=O)C(C)NCc1ccccc1CN1CCOCC1
InChIInChI=1S/C23H31N3O2/c1-17-7-6-8-18(2)22(17)25-23(27)19(3)24-15-20-9-4-5-10-21(20)16-26-11-13-28-14-12-26/h4-10,19,24H,11-16H2,1-3H3,(H,25,27)
InChIKeyLETVDGMVEPVXNA-UHFFFAOYSA-N
XLogP3.25
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.52
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide 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-(3-bromophenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide
CID 43036296
(2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide
CID 31483547
(2S)-1-(2,3-dihydroindol-1-yl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propan-1-one
CID 9396558
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide
CID 43036312
2-chloro-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]propanamide
CID 43346970
2-methyl-3-(methylamino)-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]propanamide
CID 119834774
ethane;4-[(2-methylphenyl)methyl]morpholine
CID 142083627
(2S)-N-(2,6-dimethylphenyl)-2-(thiophen-2-ylmethylamino)propanamide
CID 51687088
1-(1-cyclopropylethyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea
CID 134001880
2-(2,3-dimethylphenoxy)-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 27887006
2-amino-N-[2-(morpholin-4-ylmethyl)phenyl]propanamide;dihydrochloride
CID 119859628
2-(4-methylphenyl)-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 27887322

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide (CID 43036311) is N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide is Cc1cccc(C)c1NC(=O)C(C)NCc1ccccc1CN1CCOCC1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide?
The InChIKey is LETVDGMVEPVXNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O2/c1-17-7-6-8-18(2)22(17)25-23(27)19(3)24-15-20-9-4-5-10-21(20)16-26-11-13-28-14-12-26/h4-10,19,24H,11-16H2,1-3H3,(H,25,27).
What are the key properties of N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide?
N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide has a molecular weight of 381.52 g/mol, XLogP of 3.25, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]propanamide is sourced from PubChem (CID 43036311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).