N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide

C18H27N3O2 — CID 5177812

IUPACN'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide
SMILESC=C(NNC(=O)CN1CCOCC1)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H27N3O2/c1-14(15-5-7-16(8-6-15)18(2,3)4)19-20-17(22)13-21-9-11-23-12-10-21/h5-8,19H,1,9-13H2,2-4H3,(H,20,22)
InChIKeyKILSHESRLRJMLV-UHFFFAOYSA-N
MW317.43 g/mol
LogP1.91
Rot. Bonds5

About N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide

N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide (PubChem CID 5177812) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide.

Molecular Properties

Compound NameN'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide
PubChem CID5177812
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC NameN'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide
SMILESC=C(NNC(=O)CN1CCOCC1)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H27N3O2/c1-14(15-5-7-16(8-6-15)18(2,3)4)19-20-17(22)13-21-9-11-23-12-10-21/h5-8,19H,1,9-13H2,2-4H3,(H,20,22)
InChIKeyKILSHESRLRJMLV-UHFFFAOYSA-N
XLogP1.91
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-morpholin-4-ylacetyl)benzohydrazide
CID 8903734
2-morpholin-4-yl-N'-(3-phenylprop-1-en-2-yl)acetohydrazide
CID 3589338
N'-methyl-2-morpholin-4-ylacetohydrazide
CID 142817300
1-[4-(3-morpholin-4-ylprop-1-en-2-yl)phenyl]ethanone
CID 11507029
N'-(2-chloroacetyl)-2-morpholin-4-ylacetohydrazide
CID 23544064
4-(4-tert-butylphenoxy)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]butanamide
CID 16612050
4-tert-butyl-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 9481155
4-tert-butyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 51163379
4-tert-butyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 27258300
1-morpholin-4-ylpropan-2-yl 4-tert-butylbenzoate
CID 3151287
1-(4-tert-butylphenyl)-3-cyano-N-(2-morpholin-4-ylethyl)pyrrole-2-carboxamide
CID 42750960
N-[2-(2-fluorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide
CID 110444248

Frequently Asked Questions

What is the IUPAC name of N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide?
The IUPAC name of N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide (CID 5177812) is N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide.
What is the SMILES notation for N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide?
The canonical SMILES for N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide is C=C(NNC(=O)CN1CCOCC1)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide?
The InChIKey is KILSHESRLRJMLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-14(15-5-7-16(8-6-15)18(2,3)4)19-20-17(22)13-21-9-11-23-12-10-21/h5-8,19H,1,9-13H2,2-4H3,(H,20,22).
What are the key properties of N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide?
N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide has a molecular weight of 317.43 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-(4-tert-butylphenyl)ethenyl]-2-morpholin-4-ylacetohydrazide is sourced from PubChem (CID 5177812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).