N'-hydroxy-N-phenyloctanediamide;morpholine

C18H29N3O4 — CID 24824514

IUPACN'-hydroxy-N-phenyloctanediamide;morpholine
SMILESC1COCCN1.O=C(CCCCCCC(=O)Nc1ccccc1)NO
InChIInChI=1S/C14H20N2O3.C4H9NO/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19;1-3-6-4-2-5-1/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18);5H,1-4H2
InChIKeyRMSAQILUCOGKQV-UHFFFAOYSA-N
MW351.45 g/mol
LogP2.08
Rot. Bonds8

About N'-hydroxy-N-phenyloctanediamide;morpholine

N'-hydroxy-N-phenyloctanediamide;morpholine (PubChem CID 24824514) has the molecular formula C18H29N3O4 and a molecular weight of 351.45 g/mol. Its IUPAC name is N'-hydroxy-N-phenyloctanediamide;morpholine.

Molecular Properties

Compound NameN'-hydroxy-N-phenyloctanediamide;morpholine
PubChem CID24824514
Molecular FormulaC18H29N3O4
Molecular Weight351.45 g/mol
Exact Mass351.22
IUPAC NameN'-hydroxy-N-phenyloctanediamide;morpholine
SMILESC1COCCN1.O=C(CCCCCCC(=O)Nc1ccccc1)NO
InChIInChI=1S/C14H20N2O3.C4H9NO/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19;1-3-6-4-2-5-1/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18);5H,1-4H2
InChIKeyRMSAQILUCOGKQV-UHFFFAOYSA-N
XLogP2.08
TPSA99.69 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 52.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-hydroxy-N-phenyloctanediamide;piperazine
CID 24824516
11-anilino-11-oxoundecanoic acid
CID 150341840
44-anilino-44-oxotetratetracontanoic acid
CID 152661091
N-phenylpentacosanamide
CID 19025260
N-phenyl-10-sulfanyldecanamide
CID 89127946
N-phenyl-9-sulfanylnonanamide
CID 89127947
7-bromo-N-phenylheptanamide
CID 11266084
N-phenylheptatetracontanamide
CID 150503307
7,7-dimethyl-N-phenyloctanamide
CID 68837139
8-oxo-N-phenyloctanamide
CID 15739209
6-[dihydroxy(methyl)silyl]-N-phenylhexanamide
CID 11565230
4-[(3-anilino-3-oxopropyl)-propylamino]-N-hydroxybutanamide
CID 155124242

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-N-phenyloctanediamide;morpholine?
The IUPAC name of N'-hydroxy-N-phenyloctanediamide;morpholine (CID 24824514) is N'-hydroxy-N-phenyloctanediamide;morpholine.
What is the SMILES notation for N'-hydroxy-N-phenyloctanediamide;morpholine?
The canonical SMILES for N'-hydroxy-N-phenyloctanediamide;morpholine is C1COCCN1.O=C(CCCCCCC(=O)Nc1ccccc1)NO.
What is the InChIKey of N'-hydroxy-N-phenyloctanediamide;morpholine?
The InChIKey is RMSAQILUCOGKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3.C4H9NO/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19;1-3-6-4-2-5-1/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18);5H,1-4H2.
What are the key properties of N'-hydroxy-N-phenyloctanediamide;morpholine?
N'-hydroxy-N-phenyloctanediamide;morpholine has a molecular weight of 351.45 g/mol, XLogP of 2.08, 8 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-N-phenyloctanediamide;morpholine is sourced from PubChem (CID 24824514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).