2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide

C10H22N4 — CID 174149128

IUPAC2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide
SMILESC/C(=C\N/N=C(\N)CN(C)C)C(C)C
InChIInChI=1S/C10H22N4/c1-8(2)9(3)6-12-13-10(11)7-14(4)5/h6,8,12H,7H2,1-5H3,(H2,11,13)/b9-6+
InChIKeyATQBCPADISFNDD-RMKNXTFCSA-N
MW198.31 g/mol
LogP0.97
Rot. Bonds5

About 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide

2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide (PubChem CID 174149128) has the molecular formula C10H22N4 and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide.

Molecular Properties

Compound Name2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide
PubChem CID174149128
Molecular FormulaC10H22N4
Molecular Weight198.31 g/mol
Exact Mass198.18
IUPAC Name2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide
SMILESC/C(=C\N/N=C(\N)CN(C)C)C(C)C
InChIInChI=1S/C10H22N4/c1-8(2)9(3)6-12-13-10(11)7-14(4)5/h6,8,12H,7H2,1-5H3,(H2,11,13)/b9-6+
InChIKeyATQBCPADISFNDD-RMKNXTFCSA-N
XLogP0.97
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(E)-N,N,3,4-tetramethylpent-2-en-1-amine
CID 59115911
2-(dimethylamino)-N'-ethylethanimidamide
CID 22980368
(Z)-3-hydrazinyl-1-N,1-N-dimethylprop-2-ene-1,2-diamine
CID 145097968
[[(Z)-2,5,6-trimethylhept-4-en-3-ylidene]amino]urea
CID 5380500
(5E)-6-methoxy-1-N,1-N,3-trimethyl-4-methylideneocta-5,7-diene-1,7-diamine
CID 155721839
(E)-N,3,4-trimethyl-N-propan-2-ylpent-2-en-1-amine
CID 134511432
1-(2-aminopropyl)-1-[2-(dimethylamino)ethyl]urea
CID 82404869
1-[(E)-2,3-dimethylbut-1-enyl]-3-(2-hydroxyethyl)urea
CID 108914760
2-[2-(dimethylamino)ethyl-(2-methylpropanoyl)amino]acetic acid
CID 103802734
(E)-N'-ethyl-N,N,3,4-tetramethylpent-2-enimidamide
CID 170732072
(3E,5E)-2,3,6,7-tetramethylocta-3,5-diene
CID 143858492
2-[(Z)-[1-amino-2-(dimethylamino)ethylidene]amino]oxy-N-(2,5-dimethylphenyl)propanamide
CID 167967745

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide?
The IUPAC name of 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide (CID 174149128) is 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide.
What is the SMILES notation for 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide?
The canonical SMILES for 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide is C/C(=C\N/N=C(\N)CN(C)C)C(C)C.
What is the InChIKey of 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide?
The InChIKey is ATQBCPADISFNDD-RMKNXTFCSA-N. The full InChI is InChI=1S/C10H22N4/c1-8(2)9(3)6-12-13-10(11)7-14(4)5/h6,8,12H,7H2,1-5H3,(H2,11,13)/b9-6+.
What are the key properties of 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide?
2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide has a molecular weight of 198.31 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N'-[[(E)-2,3-dimethylbut-1-enyl]amino]ethanimidamide is sourced from PubChem (CID 174149128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).