N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide

C16H25N3O2 — CID 60926491

IUPACN,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide
SMILESCN(C)C(=O)CCNCc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C16H25N3O2/c1-18(2)16(20)7-8-17-13-14-3-5-15(6-4-14)19-9-11-21-12-10-19/h3-6,17H,7-13H2,1-2H3
InChIKeyGASYOHUBYYMQJE-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.09
Rot. Bonds6

About N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide

N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide (PubChem CID 60926491) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide
PubChem CID60926491
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC NameN,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide
SMILESCN(C)C(=O)CCNCc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C16H25N3O2/c1-18(2)16(20)7-8-17-13-14-3-5-15(6-4-14)19-9-11-21-12-10-19/h3-6,17H,7-13H2,1-2H3
InChIKeyGASYOHUBYYMQJE-UHFFFAOYSA-N
XLogP1.09
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)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,N-dimethyl-3-[(2-morpholin-4-ylphenyl)methylamino]propanamide
CID 71933821
(E)-N-[(4-morpholin-4-ylphenyl)methyl]pent-3-en-1-amine
CID 115629182
2-[(4-morpholin-4-ylphenyl)methylamino]ethyl carbamate
CID 83210921
1,1-dimethyl-3-[2-(4-morpholin-4-ylphenyl)ethyl]urea
CID 110405022
N-methyl-2-[(4-morpholin-4-ylphenyl)methylamino]ethanesulfonamide
CID 102674921
N-[(4-morpholin-4-ylphenyl)methyl]but-2-yn-1-amine
CID 113342036
3-[[4-(dimethylamino)phenyl]methyl]-1-methyl-1-[(4-morpholin-4-ylphenyl)methyl]urea
CID 38949614
1-[(4-chlorophenyl)methyl]-1-methyl-3-[(4-morpholin-4-ylphenyl)methyl]urea
CID 86831390
(4-morpholin-4-ylphenyl)methylurea
CID 142276122
3-[(4-hydroxyphenyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 112685039
3-methyl-1-[(4-morpholin-4-ylphenyl)methylamino]butan-2-ol
CID 111422027
2-cyclobutyl-N-[(4-morpholin-4-ylphenyl)methyl]ethanamine
CID 115690242

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide?
The IUPAC name of N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide (CID 60926491) is N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide.
What is the SMILES notation for N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide?
The canonical SMILES for N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide is CN(C)C(=O)CCNCc1ccc(N2CCOCC2)cc1.
What is the InChIKey of N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide?
The InChIKey is GASYOHUBYYMQJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-18(2)16(20)7-8-17-13-14-3-5-15(6-4-14)19-9-11-21-12-10-19/h3-6,17H,7-13H2,1-2H3.
What are the key properties of N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide?
N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide has a molecular weight of 291.40 g/mol, XLogP of 1.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(4-morpholin-4-ylphenyl)methylamino]propanamide is sourced from PubChem (CID 60926491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).