N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide

C19H31N3O3 — CID 5101537

IUPACN-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide
SMILESCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccco1
InChIInChI=1S/C19H31N3O3/c1-2-3-4-5-6-7-8-9-10-13-18(23)20-16-19(24)22-21-15-17-12-11-14-25-17/h11-12,14-15H,2-10,13,16H2,1H3,(H,20,23)(H,22,24)
InChIKeyLZFVFBVCHHIEEI-UHFFFAOYSA-N
MW349.48 g/mol
LogP3.77
Rot. Bonds14

About N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide

N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide (PubChem CID 5101537) has the molecular formula C19H31N3O3 and a molecular weight of 349.48 g/mol. Its IUPAC name is N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide.

Molecular Properties

Compound NameN-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide
PubChem CID5101537
Molecular FormulaC19H31N3O3
Molecular Weight349.48 g/mol
Exact Mass349.24
IUPAC NameN-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide
SMILESCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccco1
InChIInChI=1S/C19H31N3O3/c1-2-3-4-5-6-7-8-9-10-13-18(23)20-16-19(24)22-21-15-17-12-11-14-25-17/h11-12,14-15H,2-10,13,16H2,1H3,(H,20,23)(H,22,24)
InChIKeyLZFVFBVCHHIEEI-UHFFFAOYSA-N
XLogP3.77
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis(furan-2-ylmethylideneamino)decanediamide
CID 5226719
N-[2-[2-[(5-methylfuran-2-yl)methylidene]hydrazinyl]-2-oxoethyl]dodecanamide
CID 5202997
N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide
CID 136719377
N-[2-[(2Z)-2-[(2-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]dodecanamide
CID 6056379
N-[2-[2-[(4-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]dodecanamide
CID 3512313
N-[2-oxo-2-[2-(pyridin-4-ylmethylidene)hydrazinyl]ethyl]decanamide
CID 4228313
N-[(E)-furan-2-ylmethylideneamino]-2-[[2-(tritylamino)acetyl]amino]acetamide
CID 56691183
N-[2-[(2E)-2-(naphthalen-1-ylmethylidene)hydrazinyl]-2-oxoethyl]tetradecanamide
CID 45054319
N-[2-[2-(anthracen-9-ylmethylidene)hydrazinyl]-2-oxoethyl]decanamide
CID 4142604
(E)-N-[(E)-furan-2-ylmethylideneamino]-N'-[(Z)-furan-2-ylmethylideneamino]hex-3-enediamide
CID 45050499
N-[2-[(2E)-2-[(3-bromophenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide
CID 45054475
N-[2-oxo-2-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]decanamide
CID 6002218

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide?
The IUPAC name of N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide (CID 5101537) is N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide.
What is the SMILES notation for N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide?
The canonical SMILES for N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide is CCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccco1.
What is the InChIKey of N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide?
The InChIKey is LZFVFBVCHHIEEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O3/c1-2-3-4-5-6-7-8-9-10-13-18(23)20-16-19(24)22-21-15-17-12-11-14-25-17/h11-12,14-15H,2-10,13,16H2,1H3,(H,20,23)(H,22,24).
What are the key properties of N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide?
N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide has a molecular weight of 349.48 g/mol, XLogP of 3.77, 14 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide is sourced from PubChem (CID 5101537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).