(Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide

C6H12N4 — CID 146222816

IUPAC(Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide
SMILESC=NC(=C\NC)/C(N)=N/C
InChIInChI=1S/C6H12N4/c1-8-4-5(9-2)6(7)10-3/h4,8H,2H2,1,3H3,(H2,7,10)/b5-4-
InChIKeyHIPXQRXVVVMRCR-PLNGDYQASA-N
MW140.19 g/mol
LogP-0.27
Rot. Bonds3

About (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide

(Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide (PubChem CID 146222816) has the molecular formula C6H12N4 and a molecular weight of 140.19 g/mol. Its IUPAC name is (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide.

Molecular Properties

Compound Name(Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide
PubChem CID146222816
Molecular FormulaC6H12N4
Molecular Weight140.19 g/mol
Exact Mass140.11
IUPAC Name(Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide
SMILESC=NC(=C\NC)/C(N)=N/C
InChIInChI=1S/C6H12N4/c1-8-4-5(9-2)6(7)10-3/h4,8H,2H2,1,3H3,(H2,7,10)/b5-4-
InChIKeyHIPXQRXVVVMRCR-PLNGDYQASA-N
XLogP-0.27
TPSA62.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.27
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'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide?
The IUPAC name of (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide (CID 146222816) is (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide.
What is the SMILES notation for (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide?
The canonical SMILES for (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide is C=NC(=C\NC)/C(N)=N/C.
What is the InChIKey of (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide?
The InChIKey is HIPXQRXVVVMRCR-PLNGDYQASA-N. The full InChI is InChI=1S/C6H12N4/c1-8-4-5(9-2)6(7)10-3/h4,8H,2H2,1,3H3,(H2,7,10)/b5-4-.
What are the key properties of (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide?
(Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide has a molecular weight of 140.19 g/mol, XLogP of -0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-methyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide is sourced from PubChem (CID 146222816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).