molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide

C15H26N2O2 — CID 176934204

IUPACmolecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide
SMILESCCC(=O)NCC1=C(CN2CCOCC2)CCC=C1.[H][H]
InChIInChI=1S/C15H24N2O2.H2/c1-2-15(18)16-11-13-5-3-4-6-14(13)12-17-7-9-19-10-8-17;/h3,5H,2,4,6-12H2,1H3,(H,16,18);1H
InChIKeyXDLPFDHVTXPLJC-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.74
Rot. Bonds5

About molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide

molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide (PubChem CID 176934204) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide.

Molecular Properties

Compound Namemolecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide
PubChem CID176934204
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Namemolecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide
SMILESCCC(=O)NCC1=C(CN2CCOCC2)CCC=C1.[H][H]
InChIInChI=1S/C15H24N2O2.H2/c1-2-15(18)16-11-13-5-3-4-6-14(13)12-17-7-9-19-10-8-17;/h3,5H,2,4,6-12H2,1H3,(H,16,18);1H
InChIKeyXDLPFDHVTXPLJC-UHFFFAOYSA-N
XLogP1.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(3-morpholin-4-ylpropyl)-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 74239871
(3E)-2-methyl-4-methylidene-3-[[methyl(piperidin-4-ylmethyl)amino]methylidene]-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexa-1,5-diene-1-carboxamide
CID 144747424
N-(1-{[1-(2-ethoxyethyl)-1,2,5,6-tetrahydropyridin-3-yl]methyl}piperidin-3-yl)acetamide
CID 50961460
3-(4-aminobut-2-enyl)-4-(morpholin-4-ylmethyl)-1H-pyridin-2-one
CID 57279382
N-(2-morpholin-4-ylethyl)cyclohexa-1,5-diene-1-carboxamide
CID 67961870
(1S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexa-2,4-diene-1-carboxamide
CID 68092288
1-[2-amino-5-(morpholin-2-ylmethyl)-2H-pyridin-1-yl]-2,2-dimethylpropan-1-one
CID 69411816
2-amino-3-cyclohexa-1,5-dien-1-yl-N-(2-morpholin-4-ylethyl)propanamide
CID 70845444
N-[4-(2,6-dimethylmorpholine-4-carbonyl)cyclohexa-2,4-dien-1-yl]-5-(methylamino)pentanamide
CID 70974395
N-(2-methoxyethyl)-1-(2-methylcyclohexa-1,5-dien-1-yl)piperidine-4-carboxamide
CID 71047338
(4S)-4,5-dimethyl-N-(2-morpholin-4-ylethyl)cyclohexa-1,5-diene-1-carboxamide
CID 71170886
(Z,2E)-2-ethylidene-N-(2-morpholin-4-ylethyl)pent-3-enamide
CID 88899306

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide?
The IUPAC name of molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide (CID 176934204) is molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide.
What is the SMILES notation for molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide?
The canonical SMILES for molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide is CCC(=O)NCC1=C(CN2CCOCC2)CCC=C1.[H][H].
What is the InChIKey of molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide?
The InChIKey is XDLPFDHVTXPLJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.H2/c1-2-15(18)16-11-13-5-3-4-6-14(13)12-17-7-9-19-10-8-17;/h3,5H,2,4,6-12H2,1H3,(H,16,18);1H.
What are the key properties of molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide?
molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide has a molecular weight of 266.38 g/mol, XLogP of 1.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;N-[[2-(morpholin-4-ylmethyl)cyclohexa-1,5-dien-1-yl]methyl]propanamide is sourced from PubChem (CID 176934204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).