1-N',14-N'-diethyltetradecanediimidamide

C18H38N4 — CID 45484696

IUPAC1-N',14-N'-diethyltetradecanediimidamide
SMILESCC/N=C(\N)CCCCCCCCCCCC/C(N)=N\CC
InChIInChI=1S/C18H38N4/c1-3-21-17(19)15-13-11-9-7-5-6-8-10-12-14-16-18(20)22-4-2/h3-16H2,1-2H3,(H2,19,21)(H2,20,22)
InChIKeyPUTCZONAUAKYKN-UHFFFAOYSA-N
MW310.53 g/mol
LogP4.42
Rot. Bonds15

About 1-N',14-N'-diethyltetradecanediimidamide

1-N',14-N'-diethyltetradecanediimidamide (PubChem CID 45484696) has the molecular formula C18H38N4 and a molecular weight of 310.53 g/mol. Its IUPAC name is 1-N',14-N'-diethyltetradecanediimidamide.

Molecular Properties

Compound Name1-N',14-N'-diethyltetradecanediimidamide
PubChem CID45484696
Molecular FormulaC18H38N4
Molecular Weight310.53 g/mol
Exact Mass310.31
IUPAC Name1-N',14-N'-diethyltetradecanediimidamide
SMILESCC/N=C(\N)CCCCCCCCCCCC/C(N)=N\CC
InChIInChI=1S/C18H38N4/c1-3-21-17(19)15-13-11-9-7-5-6-8-10-12-14-16-18(20)22-4-2/h3-16H2,1-2H3,(H2,19,21)(H2,20,22)
InChIKeyPUTCZONAUAKYKN-UHFFFAOYSA-N
XLogP4.42
TPSA76.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.53
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

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CID 65093895
N'-ethyl-4,4,4-trifluorobutanimidamide
CID 79964264
N'-aminononanimidamide
CID 4100069
1-N',10-N'-diaminodecanediimidamide
CID 6003047
2-chloro-N'-ethylethanimidamide;hydrochloride
CID 14317600
2-(dimethylamino)-N'-ethylethanimidamide
CID 22980368
(2R,3S,4R,5S)-N-[2-[(1,8-diamino-8-propyliminooctylidene)amino]ethyl]-2,3,4,5-tetrahydroxy-N'-methylhexanediamide
CID 164711241
1-N',14-N'-bis(1-hydroxyethyl)tetradecanediimidamide
CID 141081453
N-amino-N'-ethyldecanimidamide
CID 65427174
N'-(2,2-dimethoxyethyl)pentanimidamide
CID 126622878
9,9-difluoro-N'-hydroxynonanimidamide
CID 156800054
1-N',9-N'-bis[N'-(2-ethylhexyl)carbamimidoyl]nonanediimidamide
CID 140591662

Frequently Asked Questions

What is the IUPAC name of 1-N',14-N'-diethyltetradecanediimidamide?
The IUPAC name of 1-N',14-N'-diethyltetradecanediimidamide (CID 45484696) is 1-N',14-N'-diethyltetradecanediimidamide.
What is the SMILES notation for 1-N',14-N'-diethyltetradecanediimidamide?
The canonical SMILES for 1-N',14-N'-diethyltetradecanediimidamide is CC/N=C(\N)CCCCCCCCCCCC/C(N)=N\CC.
What is the InChIKey of 1-N',14-N'-diethyltetradecanediimidamide?
The InChIKey is PUTCZONAUAKYKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N4/c1-3-21-17(19)15-13-11-9-7-5-6-8-10-12-14-16-18(20)22-4-2/h3-16H2,1-2H3,(H2,19,21)(H2,20,22).
What are the key properties of 1-N',14-N'-diethyltetradecanediimidamide?
1-N',14-N'-diethyltetradecanediimidamide has a molecular weight of 310.53 g/mol, XLogP of 4.42, 15 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N',14-N'-diethyltetradecanediimidamide is sourced from PubChem (CID 45484696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).