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

C6H11N5 — CID 139308369

IUPAC(Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide
SMILES[H]/N=C/N=C(N)/C(=C/NC)N=C
InChIInChI=1S/C6H11N5/c1-9-3-5(10-2)6(8)11-4-7/h3-4,9H,2H2,1H3,(H3,7,8,11)/b5-3-
InChIKeyCVHKODZPMOCPOA-HYXAFXHYSA-N
MW153.19 g/mol
LogP-0.29
Rot. Bonds4

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

(Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide (PubChem CID 139308369) has the molecular formula C6H11N5 and a molecular weight of 153.19 g/mol. Its IUPAC name is (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide.

Molecular Properties

Compound Name(Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide
PubChem CID139308369
Molecular FormulaC6H11N5
Molecular Weight153.19 g/mol
Exact Mass153.10
IUPAC Name(Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide
SMILES[H]/N=C/N=C(N)/C(=C/NC)N=C
InChIInChI=1S/C6H11N5/c1-9-3-5(10-2)6(8)11-4-7/h3-4,9H,2H2,1H3,(H3,7,8,11)/b5-3-
InChIKeyCVHKODZPMOCPOA-HYXAFXHYSA-N
XLogP-0.29
TPSA86.62 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
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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Related Compounds

CID 171384679
CID 171384679
CID 163794306
CID 163794306
CID 88913465
CID 88913465
CID 134462340
CID 134462340
CID 136415097
CID 136415097
CID 136430946
CID 136430946
CID 136475829
CID 136475829
CID 137030202
CID 137030202
CID 137216661
CID 137216661
CID 137289382
CID 137289382
CID 144423900
CID 144423900
CID 145257736
CID 145257736

Frequently Asked Questions

What is the IUPAC name of (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide?
The IUPAC name of (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide (CID 139308369) is (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide.
What is the SMILES notation for (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide?
The canonical SMILES for (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide is [H]/N=C/N=C(N)/C(=C/NC)N=C.
What is the InChIKey of (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide?
The InChIKey is CVHKODZPMOCPOA-HYXAFXHYSA-N. The full InChI is InChI=1S/C6H11N5/c1-9-3-5(10-2)6(8)11-4-7/h3-4,9H,2H2,1H3,(H3,7,8,11)/b5-3-.
What are the key properties of (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide?
(Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide has a molecular weight of 153.19 g/mol, XLogP of -0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-methanimidoyl-3-(methylamino)-2-(methylideneamino)prop-2-enimidamide is sourced from PubChem (CID 139308369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).