N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide

C15H30N2O3 — CID 87129980

IUPACN',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide
SMILESC=CC(=O)NN(CCCCCCO)CCCCCCO
InChIInChI=1S/C15H30N2O3/c1-2-15(20)16-17(11-7-3-5-9-13-18)12-8-4-6-10-14-19/h2,18-19H,1,3-14H2,(H,16,20)
InChIKeyGMCJIXYGYNRVKK-UHFFFAOYSA-N
MW286.42 g/mol
LogP1.61
Rot. Bonds14

About N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide

N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide (PubChem CID 87129980) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide.

Molecular Properties

Compound NameN',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide
PubChem CID87129980
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC NameN',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide
SMILESC=CC(=O)NN(CCCCCCO)CCCCCCO
InChIInChI=1S/C15H30N2O3/c1-2-15(20)16-17(11-7-3-5-9-13-18)12-8-4-6-10-14-19/h2,18-19H,1,3-14H2,(H,16,20)
InChIKeyGMCJIXYGYNRVKK-UHFFFAOYSA-N
XLogP1.61
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N-bis(5-hydroxypentyl)prop-2-enamide
CID 87130034
N-[3-(dioctylamino)propyl]prop-2-enamide
CID 54306964
N-(3-hydroxypropyl)prop-2-enamide
CID 87194577
N-(5-hydroxypentyl)-N-prop-2-enylprop-2-enamide
CID 135128737
N'-(4-hydroxybutyl)prop-2-enehydrazide
CID 87129975
N-[3-[hexyl(methyl)amino]propyl]prop-2-enamide
CID 129275452
octadecan-1-ol;prop-2-enoic acid
CID 88814637
hexadecan-1-ol;bis(prop-2-enoic acid)
CID 175738657
N-[3-[bis(2-hydroxyethoxy)amino]propyl]prop-2-enamide
CID 87923177
N-[3-[12-(dimethylamino)dodecyl-methylamino]propyl]prop-2-enamide
CID 118567429
bis(octan-1-ol);bis(prop-2-enoate);zirconium(2+)
CID 159808494
6-[6-hydroxyhexyl(prop-2-enyl)amino]hexan-1-ol
CID 87378049

Frequently Asked Questions

What is the IUPAC name of N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide?
The IUPAC name of N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide (CID 87129980) is N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide.
What is the SMILES notation for N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide?
The canonical SMILES for N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide is C=CC(=O)NN(CCCCCCO)CCCCCCO.
What is the InChIKey of N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide?
The InChIKey is GMCJIXYGYNRVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-2-15(20)16-17(11-7-3-5-9-13-18)12-8-4-6-10-14-19/h2,18-19H,1,3-14H2,(H,16,20).
What are the key properties of N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide?
N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide has a molecular weight of 286.42 g/mol, XLogP of 1.61, 14 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-bis(6-hydroxyhexyl)prop-2-enehydrazide is sourced from PubChem (CID 87129980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).