N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine

C14H23N5 — CID 134698846

IUPACN,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine
SMILESC=C(C)CN1CCN(c2cncc(N(C)C)n2)CC1
InChIInChI=1S/C14H23N5/c1-12(2)11-18-5-7-19(8-6-18)14-10-15-9-13(16-14)17(3)4/h9-10H,1,5-8,11H2,2-4H3
InChIKeyNGCPLUHQSVWUMO-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.24
Rot. Bonds4

About N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine

N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine (PubChem CID 134698846) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine
PubChem CID134698846
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC NameN,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine
SMILESC=C(C)CN1CCN(c2cncc(N(C)C)n2)CC1
InChIInChI=1S/C14H23N5/c1-12(2)11-18-5-7-19(8-6-18)14-10-15-9-13(16-14)17(3)4/h9-10H,1,5-8,11H2,2-4H3
InChIKeyNGCPLUHQSVWUMO-UHFFFAOYSA-N
XLogP1.24
TPSA35.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine?
The IUPAC name of N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine (CID 134698846) is N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine.
What is the SMILES notation for N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine?
The canonical SMILES for N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine is C=C(C)CN1CCN(c2cncc(N(C)C)n2)CC1.
What is the InChIKey of N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine?
The InChIKey is NGCPLUHQSVWUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-12(2)11-18-5-7-19(8-6-18)14-10-15-9-13(16-14)17(3)4/h9-10H,1,5-8,11H2,2-4H3.
What are the key properties of N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine?
N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine has a molecular weight of 261.37 g/mol, XLogP of 1.24, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyrazin-2-amine is sourced from PubChem (CID 134698846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).