2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide

C10H24N4O — CID 76912572

IUPAC2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide
SMILESCC(C)CN(CCN(C)C)CC(N)=NO
InChIInChI=1S/C10H24N4O/c1-9(2)7-14(6-5-13(3)4)8-10(11)12-15/h9,15H,5-8H2,1-4H3,(H2,11,12)
InChIKeyDHPYBOVPKPJBKH-UHFFFAOYSA-N
MW216.33 g/mol
LogP0.25
Rot. Bonds7

About 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide

2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide (PubChem CID 76912572) has the molecular formula C10H24N4O and a molecular weight of 216.33 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide
PubChem CID76912572
Molecular FormulaC10H24N4O
Molecular Weight216.33 g/mol
Exact Mass216.20
IUPAC Name2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide
SMILESCC(C)CN(CCN(C)C)CC(N)=NO
InChIInChI=1S/C10H24N4O/c1-9(2)7-14(6-5-13(3)4)8-10(11)12-15/h9,15H,5-8H2,1-4H3,(H2,11,12)
InChIKeyDHPYBOVPKPJBKH-UHFFFAOYSA-N
XLogP0.25
TPSA65.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(Z)-2-amino-N,N,N-triethyl-2-(hydroxyimino)ethanaminium chloride
CID 9579592
(2-Amino-2-hydroxyiminoethyl)-triethylazanium
CID 657482
2-[2-fluoroethyl(propyl)amino]-N'-hydroxyethanimidamide
CID 80695713
2-[ethyl(3-fluoropropyl)amino]-N'-hydroxyethanimidamide
CID 81106381
2-[3-fluoropropyl(propyl)amino]-N'-hydroxyethanimidamide
CID 81106491
(2-Amino-2-hydroxyiminoethyl)-triethylazanium chloride
CID 85039051
2-[[2-(dimethylamino)ethyl-(2-methylpropyl)amino]methyl]-3,3,3-trifluoro-N'-hydroxypropanimidamide
CID 103369360
2-[[2-(dimethylamino)ethyl-propylamino]methyl]-3,3,3-trifluoro-N'-hydroxypropanimidamide
CID 103369371
2-[[2-(dimethylamino)ethyl-methylamino]methyl]-3,3,3-trifluoro-N'-hydroxypropanimidamide
CID 103369436
2-(dibutylamino)-N'-hydroxyethanimidamide
CID 43125983
2-(dibutylamino)-N'-hydroxyethanimidamide
CID 74859795
[(2E)-2-amino-2-hydroxyiminoethyl]-triethylazanium
CID 5389003

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide (CID 76912572) is 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide is CC(C)CN(CCN(C)C)CC(N)=NO.
What is the InChIKey of 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide?
The InChIKey is DHPYBOVPKPJBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N4O/c1-9(2)7-14(6-5-13(3)4)8-10(11)12-15/h9,15H,5-8H2,1-4H3,(H2,11,12).
What are the key properties of 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide?
2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide has a molecular weight of 216.33 g/mol, XLogP of 0.25, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-N'-hydroxyethanimidamide is sourced from PubChem (CID 76912572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).