N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide

C32H42N4O6 — CID 17080133

IUPACN,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide
SMILESO=C(CCCCCCCCC(=O)Nc1ccccc1C(=O)N1CCOCC1)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C32H42N4O6/c37-29(33-27-13-9-7-11-25(27)31(39)35-17-21-41-22-18-35)15-5-3-1-2-4-6-16-30(38)34-28-14-10-8-12-26(28)32(40)36-19-23-42-24-20-36/h7-14H,1-6,15-24H2,(H,33,37)(H,34,38)
InChIKeyGZQKQTMWDZMCPB-UHFFFAOYSA-N
MW578.71 g/mol
LogP4.33
Rot. Bonds13

About N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide

N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide (PubChem CID 17080133) has the molecular formula C32H42N4O6 and a molecular weight of 578.71 g/mol. Its IUPAC name is N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide.

Molecular Properties

Compound NameN,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide
PubChem CID17080133
Molecular FormulaC32H42N4O6
Molecular Weight578.71 g/mol
Exact Mass578.31
IUPAC NameN,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide
SMILESO=C(CCCCCCCCC(=O)Nc1ccccc1C(=O)N1CCOCC1)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C32H42N4O6/c37-29(33-27-13-9-7-11-25(27)31(39)35-17-21-41-22-18-35)15-5-3-1-2-4-6-16-30(38)34-28-14-10-8-12-26(28)32(40)36-19-23-42-24-20-36/h7-14H,1-6,15-24H2,(H,33,37)(H,34,38)
InChIKeyGZQKQTMWDZMCPB-UHFFFAOYSA-N
XLogP4.33
TPSA117.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms42
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500578.71
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

7-amino-N-[2-(morpholine-4-carbonyl)phenyl]heptanamide
CID 119703947
N,N'-bis[2-(piperidine-1-carbonyl)phenyl]decanediamide
CID 17080136
N-[[2-(morpholine-4-carbonyl)phenyl]carbamothioyl]tetradecanamide
CID 54791918
3-(2,5-dioxopyrrolidin-1-yl)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
CID 35328696
3-(benzenesulfonyl)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
CID 6461370
3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
CID 35329167
N-[2-(morpholine-4-carbonyl)phenyl]-3-naphthalen-1-ylpropanamide
CID 53278693
3-(2-aminophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide;hydrochloride
CID 120608564
N-[2-(azepane-1-carbonyl)phenyl]octanamide
CID 4958626
7-amino-N-[2-(pyrrolidine-1-carbonyl)phenyl]heptanamide;hydrochloride
CID 119684692
3-(1H-indol-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
CID 35326224
2-(2-fluorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
CID 35325829

Frequently Asked Questions

What is the IUPAC name of N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide?
The IUPAC name of N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide (CID 17080133) is N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide.
What is the SMILES notation for N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide?
The canonical SMILES for N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide is O=C(CCCCCCCCC(=O)Nc1ccccc1C(=O)N1CCOCC1)Nc1ccccc1C(=O)N1CCOCC1.
What is the InChIKey of N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide?
The InChIKey is GZQKQTMWDZMCPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H42N4O6/c37-29(33-27-13-9-7-11-25(27)31(39)35-17-21-41-22-18-35)15-5-3-1-2-4-6-16-30(38)34-28-14-10-8-12-26(28)32(40)36-19-23-42-24-20-36/h7-14H,1-6,15-24H2,(H,33,37)(H,34,38).
What are the key properties of N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide?
N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide has a molecular weight of 578.71 g/mol, XLogP of 4.33, 13 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide is sourced from PubChem (CID 17080133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).