N'-prop-2-enylpiperazine-1-carboximidamide

C8H16N4 — CID 123817252

IUPACN'-prop-2-enylpiperazine-1-carboximidamide
SMILESC=CC/N=C(\N)N1CCNCC1
InChIInChI=1S/C8H16N4/c1-2-3-11-8(9)12-6-4-10-5-7-12/h2,10H,1,3-7H2,(H2,9,11)
InChIKeyOVQVNQUCAQMLMM-UHFFFAOYSA-N
MW168.24 g/mol
LogP-0.61
Rot. Bonds2

About N'-prop-2-enylpiperazine-1-carboximidamide

N'-prop-2-enylpiperazine-1-carboximidamide (PubChem CID 123817252) has the molecular formula C8H16N4 and a molecular weight of 168.24 g/mol. Its IUPAC name is N'-prop-2-enylpiperazine-1-carboximidamide.

Molecular Properties

Compound NameN'-prop-2-enylpiperazine-1-carboximidamide
PubChem CID123817252
Molecular FormulaC8H16N4
Molecular Weight168.24 g/mol
Exact Mass168.14
IUPAC NameN'-prop-2-enylpiperazine-1-carboximidamide
SMILESC=CC/N=C(\N)N1CCNCC1
InChIInChI=1S/C8H16N4/c1-2-3-11-8(9)12-6-4-10-5-7-12/h2,10H,1,3-7H2,(H2,9,11)
InChIKeyOVQVNQUCAQMLMM-UHFFFAOYSA-N
XLogP-0.61
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 5-0.61
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'}

Analyze N'-prop-2-enylpiperazine-1-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-N'-prop-2-enyl-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide
CID 109376449
N'-methyl-N-prop-2-enyl-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide
CID 109376941
1,1,2,3-Tetrakis(prop-2-enyl)guanidine
CID 21753361
2-piperazin-1-yl-4H-pyrimidine-3-carbonitrile
CID 53892295
2-(4-Methylpiperazin-1-yl)-1,4-dihydropyrimidine
CID 54066096
3-piperazin-2-yl-4H-pyrimidine
CID 57229577
1-Prop-2-enylpiperazine-2,2-diamine
CID 66900155
1-[4-(1-Aminoprop-2-enyl)piperazin-1-yl]prop-2-en-1-amine
CID 70270391
2-Piperazin-1-yl-1,4-dihydropyrimidine
CID 89128712
3-(piperazin-1-ylmethyl)-4H-pyrimidine
CID 90821929
1-(1-But-2-enyl-4-methyl-4,5-dihydroimidazol-2-yl)piperazine
CID 90847682
4-Piperazin-1-yl-1,4-dihydropyrimidine
CID 91011480

Frequently Asked Questions

What is the IUPAC name of N'-prop-2-enylpiperazine-1-carboximidamide?
The IUPAC name of N'-prop-2-enylpiperazine-1-carboximidamide (CID 123817252) is N'-prop-2-enylpiperazine-1-carboximidamide.
What is the SMILES notation for N'-prop-2-enylpiperazine-1-carboximidamide?
The canonical SMILES for N'-prop-2-enylpiperazine-1-carboximidamide is C=CC/N=C(\N)N1CCNCC1.
What is the InChIKey of N'-prop-2-enylpiperazine-1-carboximidamide?
The InChIKey is OVQVNQUCAQMLMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4/c1-2-3-11-8(9)12-6-4-10-5-7-12/h2,10H,1,3-7H2,(H2,9,11).
What are the key properties of N'-prop-2-enylpiperazine-1-carboximidamide?
N'-prop-2-enylpiperazine-1-carboximidamide has a molecular weight of 168.24 g/mol, XLogP of -0.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-prop-2-enylpiperazine-1-carboximidamide is sourced from PubChem (CID 123817252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).