(Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine

C10H20N4O — CID 118973161

IUPAC(Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine
SMILES[H]/N=C(/C=C(\N=C)N(C)C)CC(C)ONC
InChIInChI=1S/C10H20N4O/c1-8(15-13-3)6-9(11)7-10(12-2)14(4)5/h7-8,11,13H,2,6H2,1,3-5H3/b10-7+,11-9+
InChIKeyNBPXTLSVMNMUFW-PPZOTWNKSA-N
MW212.30 g/mol
LogP1.04
Rot. Bonds7

About (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine

(Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine (PubChem CID 118973161) has the molecular formula C10H20N4O and a molecular weight of 212.30 g/mol. Its IUPAC name is (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine
PubChem CID118973161
Molecular FormulaC10H20N4O
Molecular Weight212.30 g/mol
Exact Mass212.16
IUPAC Name(Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine
SMILES[H]/N=C(/C=C(\N=C)N(C)C)CC(C)ONC
InChIInChI=1S/C10H20N4O/c1-8(15-13-3)6-9(11)7-10(12-2)14(4)5/h7-8,11,13H,2,6H2,1,3-5H3/b10-7+,11-9+
InChIKeyNBPXTLSVMNMUFW-PPZOTWNKSA-N
XLogP1.04
TPSA60.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine with MolForge

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Related Compounds

N-(4-iminohex-5-en-2-yl)hydroxylamine
CID 175421103
(Z)-N-ethyl-3-imino-N-methyl-1-(methylideneamino)prop-1-en-1-amine
CID 90453488
(Z)-6-methylhept-2-en-4-imine
CID 91390862
(E)-3-(2-hydroxyethylamino)-N-methylidenebut-2-enimidamide
CID 142337016
(1Z,4E)-1-N,1-N,2-trimethyl-5-(methylaminooxy)-1-(methylideneamino)hexa-1,4-diene-1,3-diamine
CID 90452911
1-ethyl-1-methyl-3-methylideneguanidine
CID 59950676
1-methyl-3-methylidene-1-[(Z)-propylideneamino]guanidine
CID 90839193
5-methyloct-1-en-3-imine
CID 163230463
ethane;1-methyl-3-methylidene-1-[(2S)-pentan-2-yl]guanidine;2-methylprop-1-ene
CID 143987193
ethane;N-(2-methoxyethyl)-N,2-dimethylpropanimidamide
CID 143160692
N-(1-bromoethyl)-N-ethenylpropanimidamide
CID 146638836
methylamino 2-chloroethanimidate
CID 142422213

Frequently Asked Questions

What is the IUPAC name of (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine?
The IUPAC name of (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine (CID 118973161) is (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine.
What is the SMILES notation for (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine?
The canonical SMILES for (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine is [H]/N=C(/C=C(\N=C)N(C)C)CC(C)ONC.
What is the InChIKey of (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine?
The InChIKey is NBPXTLSVMNMUFW-PPZOTWNKSA-N. The full InChI is InChI=1S/C10H20N4O/c1-8(15-13-3)6-9(11)7-10(12-2)14(4)5/h7-8,11,13H,2,6H2,1,3-5H3/b10-7+,11-9+.
What are the key properties of (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine?
(Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine has a molecular weight of 212.30 g/mol, XLogP of 1.04, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-imino-N,N-dimethyl-5-(methylaminooxy)-1-(methylideneamino)hex-1-en-1-amine is sourced from PubChem (CID 118973161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).