(Z)-3-amino-N'-prop-2-enylprop-2-enimidamide

C6H11N3 — CID 130444380

IUPAC(Z)-3-amino-N'-prop-2-enylprop-2-enimidamide
SMILESC=CC/N=C(N)/C=C\N
InChIInChI=1S/C6H11N3/c1-2-5-9-6(8)3-4-7/h2-4H,1,5,7H2,(H2,8,9)/b4-3-
InChIKeyNVXIRJLJYHUKTM-ARJAWSKDSA-N
MW125.17 g/mol
LogP0.00
Rot. Bonds3

About (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide

(Z)-3-amino-N'-prop-2-enylprop-2-enimidamide (PubChem CID 130444380) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide.

Molecular Properties

Compound Name(Z)-3-amino-N'-prop-2-enylprop-2-enimidamide
PubChem CID130444380
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name(Z)-3-amino-N'-prop-2-enylprop-2-enimidamide
SMILESC=CC/N=C(N)/C=C\N
InChIInChI=1S/C6H11N3/c1-2-5-9-6(8)3-4-7/h2-4H,1,5,7H2,(H2,8,9)/b4-3-
InChIKeyNVXIRJLJYHUKTM-ARJAWSKDSA-N
XLogP0.00
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1,2-Dihydro-4-pyrimidinamine
CID 135398678
(E)-N'-ethenyl-3-fluorobut-2-enimidamide
CID 142337031
3-amino-N'-(2,2,2-trifluoroethyl)prop-2-enimidamide
CID 173698748
2-Methyl-1,4-dihydropyrimidine
CID 13432429
carbanide;2H-pyrimidin-2-id-4-amine;uranium(2+)
CID 20644769
N'-ethenylprop-2-enimidamide
CID 23073048
Azet-2-amine
CID 55288848
2-ethenyl-1H-1,3-diazepine
CID 56992451
3-deuterio-2-ethenyl-4H-pyrimidine
CID 87130852
N'-methyl-N-[(Z)-prop-1-enyl]ethanimidamide
CID 87171545
N'-ethenylprop-2-enimidamide;hydrochloride
CID 87403639
N'-(2-aminoethyl)prop-2-enimidamide
CID 88827546

Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide?
The IUPAC name of (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide (CID 130444380) is (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide.
What is the SMILES notation for (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide?
The canonical SMILES for (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide is C=CC/N=C(N)/C=C\N.
What is the InChIKey of (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide?
The InChIKey is NVXIRJLJYHUKTM-ARJAWSKDSA-N. The full InChI is InChI=1S/C6H11N3/c1-2-5-9-6(8)3-4-7/h2-4H,1,5,7H2,(H2,8,9)/b4-3-.
What are the key properties of (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide?
(Z)-3-amino-N'-prop-2-enylprop-2-enimidamide has a molecular weight of 125.17 g/mol, XLogP of 0.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-N'-prop-2-enylprop-2-enimidamide is sourced from PubChem (CID 130444380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).