N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid

C15H28N4O5 — CID 154909175

IUPACN,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid
SMILESCN1CCN(C(=O)CN2CCOC(C(=O)N(C)C)C2)CC1.O=CO
InChIInChI=1S/C14H26N4O3.CH2O2/c1-15(2)14(20)12-10-17(8-9-21-12)11-13(19)18-6-4-16(3)5-7-18;2-1-3/h12H,4-11H2,1-3H3;1H,(H,2,3)
InChIKeyVSVNBAGBSLYFBG-UHFFFAOYSA-N
MW344.41 g/mol
LogP-1.75
Rot. Bonds3

About N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid

N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid (PubChem CID 154909175) has the molecular formula C15H28N4O5 and a molecular weight of 344.41 g/mol. Its IUPAC name is N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid.

Molecular Properties

Compound NameN,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid
PubChem CID154909175
Molecular FormulaC15H28N4O5
Molecular Weight344.41 g/mol
Exact Mass344.21
IUPAC NameN,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid
SMILESCN1CCN(C(=O)CN2CCOC(C(=O)N(C)C)C2)CC1.O=CO
InChIInChI=1S/C14H26N4O3.CH2O2/c1-15(2)14(20)12-10-17(8-9-21-12)11-13(19)18-6-4-16(3)5-7-18;2-1-3/h12H,4-11H2,1-3H3;1H,(H,2,3)
InChIKeyVSVNBAGBSLYFBG-UHFFFAOYSA-N
XLogP-1.75
TPSA93.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 5-1.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid 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-4-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-2-carboxamide
CID 131925823
N,N-dimethyl-4-propylmorpholine-2-carboxamide
CID 177158448
1,2-bis(4-methylpiperazin-1-yl)ethanone
CID 160964399
1-(4-acetylpiperazin-1-yl)-2-[2-(aminomethyl)morpholin-4-yl]ethanone
CID 114395313
2-(3-aminopyrrolidin-1-yl)-1-(4-methylpiperazin-1-yl)ethanone
CID 62068636
4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N,N-dimethylmorpholine-2-carboxamide
CID 131902756
N,N-dimethyl-4-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]morpholine-2-carboxamide
CID 131928614
4-[2-(2-methoxyanilino)-2-oxoethyl]-N,N-dimethylmorpholine-2-carboxamide
CID 171327785
1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-3-carboxylic acid
CID 43385889
2-[3-(methylamino)piperidin-1-yl]-1-(4-methylpiperazin-1-yl)ethanone
CID 62545473
4-[(3-ethyl-1H-1,2,4-triazol-5-yl)methyl]-N,N-dimethylmorpholine-2-carboxamide
CID 131935697
2-[2-(hydroxymethyl)morpholin-4-yl]-1-pyrrolidin-1-ylethanone
CID 79840662

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid?
The IUPAC name of N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid (CID 154909175) is N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid.
What is the SMILES notation for N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid?
The canonical SMILES for N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid is CN1CCN(C(=O)CN2CCOC(C(=O)N(C)C)C2)CC1.O=CO.
What is the InChIKey of N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid?
The InChIKey is VSVNBAGBSLYFBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O3.CH2O2/c1-15(2)14(20)12-10-17(8-9-21-12)11-13(19)18-6-4-16(3)5-7-18;2-1-3/h12H,4-11H2,1-3H3;1H,(H,2,3).
What are the key properties of N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid?
N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid has a molecular weight of 344.41 g/mol, XLogP of -1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]morpholine-2-carboxamide;formic acid is sourced from PubChem (CID 154909175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).