2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide

C11H20N4 — CID 144745253

IUPAC2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide
SMILESC=N/C(=N\C=C/C)N1CCNCC1(C)C
InChIInChI=1S/C11H20N4/c1-5-6-14-10(12-4)15-8-7-13-9-11(15,2)3/h5-6,13H,4,7-9H2,1-3H3/b6-5-,14-10+
InChIKeySZGCFOTUFOKWBB-WULNTPNUSA-N
MW208.31 g/mol
LogP1.26
Rot. Bonds1

About 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide

2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide (PubChem CID 144745253) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide.

Molecular Properties

Compound Name2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide
PubChem CID144745253
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide
SMILESC=N/C(=N\C=C/C)N1CCNCC1(C)C
InChIInChI=1S/C11H20N4/c1-5-6-14-10(12-4)15-8-7-13-9-11(15,2)3/h5-6,13H,4,7-9H2,1-3H3/b6-5-,14-10+
InChIKeySZGCFOTUFOKWBB-WULNTPNUSA-N
XLogP1.26
TPSA39.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

3-(piperazin-1-ylmethyl)-4H-pyrimidine
CID 90821929
1-piperazin-1-yl-N-[(E)-prop-1-enyl]methanimine
CID 118489766
N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide
CID 129253175
4,4-dimethyl-2-piperazin-1-yl-1H-pyrimidine
CID 139986213
3-methyl-2-piperazin-1-yl-4H-pyrimidine
CID 143573084
ethane;N'-ethenyl-N-methylidenepiperazine-1-carboximidamide
CID 168939199
N-[3-(4-methylpiperazin-1-yl)propyl]-1,4-dihydropyrimidin-2-amine
CID 173123556
N-(1-methylpiperidin-3-yl)-1,4-dihydropyrimidin-4-amine
CID 173471221
4-(4-Methylpiperazin-1-yl)-1,4-dihydropyrimidine
CID 173471256
4-deuterio-4-[(2R,5R)-2,5-dimethylpiperazin-1-yl]-1H-pyrimidine
CID 175849285
2-[2-Methyl-2-(4-methylpiperazin-1-yl)propyl]-1-prop-2-enylguanidine;hydroiodide
CID 54732009
2-[2-Methyl-2-(4-methylpiperazin-1-yl)propyl]-1-prop-2-enylguanidine
CID 54732010

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide?
The IUPAC name of 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide (CID 144745253) is 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide.
What is the SMILES notation for 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide?
The canonical SMILES for 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide is C=N/C(=N\C=C/C)N1CCNCC1(C)C.
What is the InChIKey of 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide?
The InChIKey is SZGCFOTUFOKWBB-WULNTPNUSA-N. The full InChI is InChI=1S/C11H20N4/c1-5-6-14-10(12-4)15-8-7-13-9-11(15,2)3/h5-6,13H,4,7-9H2,1-3H3/b6-5-,14-10+.
What are the key properties of 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide?
2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide has a molecular weight of 208.31 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide is sourced from PubChem (CID 144745253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).