N-[(Z)-prop-1-enyl]iminopropanimidamide

C6H11N3 — CID 144524020

IUPACN-[(Z)-prop-1-enyl]iminopropanimidamide
SMILES[H]/N=C(CC)/N=N/C=C\C
InChIInChI=1S/C6H11N3/c1-3-5-8-9-6(7)4-2/h3,5,7H,4H2,1-2H3/b5-3-,7-6+,9-8+
InChIKeyPPWQWNCKZMCUSH-CBKAIFBSSA-N
MW125.17 g/mol
LogP2.36
Rot. Bonds2

About N-[(Z)-prop-1-enyl]iminopropanimidamide

N-[(Z)-prop-1-enyl]iminopropanimidamide (PubChem CID 144524020) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is N-[(Z)-prop-1-enyl]iminopropanimidamide.

Molecular Properties

Compound NameN-[(Z)-prop-1-enyl]iminopropanimidamide
PubChem CID144524020
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC NameN-[(Z)-prop-1-enyl]iminopropanimidamide
SMILES[H]/N=C(CC)/N=N/C=C\C
InChIInChI=1S/C6H11N3/c1-3-5-8-9-6(7)4-2/h3,5,7H,4H2,1-2H3/b5-3-,7-6+,9-8+
InChIKeyPPWQWNCKZMCUSH-CBKAIFBSSA-N
XLogP2.36
TPSA48.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-oxopropanimidamide
CID 174117199
4-ethylidenehept-5-en-3-imine
CID 123855505
N'-propanimidoylpropanimidamide
CID 58804639
N,N-dimethyl-N'-[(Z)-prop-1-enyl]propanimidamide
CID 170048230
N-[(Z)-prop-1-enyl]butan-2-imine
CID 11126202
prop-1-enyldiazene
CID 20770475
(Z)-hept-5-ene-3,4-diimine
CID 123802177
2,2-dimethyl-N-[(Z)-prop-1-enyl]pentan-3-imine
CID 155014494
(2Z,6Z,8Z)-8-ethyldeca-2,6,8-triene-4,5-diimine
CID 156548687
(E)-hex-4-en-2-imine
CID 15835471
CID 90783980
CID 90783980
ethane;[(1Z,4Z)-hexa-1,4-dienyl]diazene
CID 145324664

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-prop-1-enyl]iminopropanimidamide?
The IUPAC name of N-[(Z)-prop-1-enyl]iminopropanimidamide (CID 144524020) is N-[(Z)-prop-1-enyl]iminopropanimidamide.
What is the SMILES notation for N-[(Z)-prop-1-enyl]iminopropanimidamide?
The canonical SMILES for N-[(Z)-prop-1-enyl]iminopropanimidamide is [H]/N=C(CC)/N=N/C=C\C.
What is the InChIKey of N-[(Z)-prop-1-enyl]iminopropanimidamide?
The InChIKey is PPWQWNCKZMCUSH-CBKAIFBSSA-N. The full InChI is InChI=1S/C6H11N3/c1-3-5-8-9-6(7)4-2/h3,5,7H,4H2,1-2H3/b5-3-,7-6+,9-8+.
What are the key properties of N-[(Z)-prop-1-enyl]iminopropanimidamide?
N-[(Z)-prop-1-enyl]iminopropanimidamide has a molecular weight of 125.17 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-prop-1-enyl]iminopropanimidamide is sourced from PubChem (CID 144524020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).