3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine

C10H18N4 — CID 91410286

IUPAC3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine
SMILESCCN=C(/C=N/CC)C(/C=N/C)=N/C
InChIInChI=1S/C10H18N4/c1-5-13-8-10(14-6-2)9(12-4)7-11-3/h7-8H,5-6H2,1-4H3/b11-7+,12-9+,13-8+,14-10+
InChIKeyJDIRVBQLWFLPFH-OWFGURNWSA-N
MW194.28 g/mol
LogP1.31
Rot. Bonds5

About 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine

3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine (PubChem CID 91410286) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine.

Molecular Properties

Compound Name3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine
PubChem CID91410286
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine
SMILESCCN=C(/C=N/CC)C(/C=N/C)=N/C
InChIInChI=1S/C10H18N4/c1-5-13-8-10(14-6-2)9(12-4)7-11-3/h7-8H,5-6H2,1-4H3/b11-7+,12-9+,13-8+,14-10+
InChIKeyJDIRVBQLWFLPFH-OWFGURNWSA-N
XLogP1.31
TPSA49.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

ethane;(E)-4-ethylimino-N,3-dimethylbut-2-en-2-amine
CID 144831826
(E)-3-(ethyliminomethyl)-4-hydroxypent-3-en-2-one
CID 146028410
N-ethyl-4-ethylimino-N-methyl-3-methyliminobutan-1-amine
CID 123984446
(E)-3-chloro-N,2-dimethylpent-2-en-1-imine
CID 176921489
N,N'-dimethyl-2-methyliminoethanimidamide
CID 90453900
N-ethyl-2-(trifluoromethyl)prop-2-en-1-imine
CID 139563812
1-N-ethyl-2-N-pentylbutane-1,2-diimine
CID 91053831
(Z)-N-ethyl-2-phenylpent-2-en-1-imine
CID 143898078
(2Z,6E)-N-ethyl-5-methylideneocta-2,6-dien-4-imine
CID 145498144
ethane;(Z)-3-ethylimino-2-(3-methylphenyl)prop-1-en-1-amine
CID 166546337
(2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide
CID 168913138
3-(ethyliminomethyl)but-3-enoic acid
CID 154029010

Frequently Asked Questions

What is the IUPAC name of 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine?
The IUPAC name of 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine (CID 91410286) is 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine.
What is the SMILES notation for 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine?
The canonical SMILES for 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine is CCN=C(/C=N/CC)C(/C=N/C)=N/C.
What is the InChIKey of 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine?
The InChIKey is JDIRVBQLWFLPFH-OWFGURNWSA-N. The full InChI is InChI=1S/C10H18N4/c1-5-13-8-10(14-6-2)9(12-4)7-11-3/h7-8H,5-6H2,1-4H3/b11-7+,12-9+,13-8+,14-10+.
What are the key properties of 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine?
3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine has a molecular weight of 194.28 g/mol, XLogP of 1.31, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,4-N-diethyl-1-N,2-N-dimethylbutane-1,2,3,4-tetraimine is sourced from PubChem (CID 91410286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).