N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride

C18H26ClN3O3 — CID 119744250

IUPACN-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
SMILESCC1CN(C(=O)c2ccc(NC(=O)C3CCNC3)cc2)CC(C)O1.Cl
InChIInChI=1S/C18H25N3O3.ClH/c1-12-10-21(11-13(2)24-12)18(23)14-3-5-16(6-4-14)20-17(22)15-7-8-19-9-15;/h3-6,12-13,15,19H,7-11H2,1-2H3,(H,20,22);1H
InChIKeyDALDIXLFPSLRJJ-UHFFFAOYSA-N
MW367.88 g/mol
LogP1.91
Rot. Bonds3

About N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride

N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 119744250) has the molecular formula C18H26ClN3O3 and a molecular weight of 367.88 g/mol. Its IUPAC name is N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
PubChem CID119744250
Molecular FormulaC18H26ClN3O3
Molecular Weight367.88 g/mol
Exact Mass367.17
IUPAC NameN-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
SMILESCC1CN(C(=O)c2ccc(NC(=O)C3CCNC3)cc2)CC(C)O1.Cl
InChIInChI=1S/C18H25N3O3.ClH/c1-12-10-21(11-13(2)24-12)18(23)14-3-5-16(6-4-14)20-17(22)15-7-8-19-9-15;/h3-6,12-13,15,19H,7-11H2,1-2H3,(H,20,22);1H
InChIKeyDALDIXLFPSLRJJ-UHFFFAOYSA-N
XLogP1.91
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.88
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride 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

3-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119744216
2-[[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]carbamoyl]cyclobutane-1-carboxylic acid
CID 120975409
N-[[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]methyl]piperidine-3-carboxamide
CID 119305558
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea
CID 42915501
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918
N-[4-(ethylcarbamoyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119714145
N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119744220
2-(cyclopropylmethylamino)-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]acetamide;hydrochloride
CID 119744228
(2,6-dimethylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride
CID 119669803
(3S)-N-[5-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]-2-methylphenyl]pyrrolidine-3-carboxamide
CID 124889380
2-(cyclopropylmethylamino)-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]acetamide
CID 119744229
N-(4-chlorophenyl)pyrrolidine-3-carboxamide
CID 63006642

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride (CID 119744250) is N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride is CC1CN(C(=O)c2ccc(NC(=O)C3CCNC3)cc2)CC(C)O1.Cl.
What is the InChIKey of N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is DALDIXLFPSLRJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3.ClH/c1-12-10-21(11-13(2)24-12)18(23)14-3-5-16(6-4-14)20-17(22)15-7-8-19-9-15;/h3-6,12-13,15,19H,7-11H2,1-2H3,(H,20,22);1H.
What are the key properties of N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride?
N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 367.88 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119744250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).