5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine

C12H21N5 — CID 168776208

IUPAC5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine
SMILESCC(C)Nc1cnc(N2CCN(C)CC2)cn1
InChIInChI=1S/C12H21N5/c1-10(2)15-11-8-14-12(9-13-11)17-6-4-16(3)5-7-17/h8-10H,4-7H2,1-3H3,(H,13,15)
InChIKeyMPVKORYKCAFDLE-UHFFFAOYSA-N
MW235.34 g/mol
LogP1.05
Rot. Bonds3

About 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine

5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine (PubChem CID 168776208) has the molecular formula C12H21N5 and a molecular weight of 235.34 g/mol. Its IUPAC name is 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine.

Molecular Properties

Compound Name5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine
PubChem CID168776208
Molecular FormulaC12H21N5
Molecular Weight235.34 g/mol
Exact Mass235.18
IUPAC Name5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine
SMILESCC(C)Nc1cnc(N2CCN(C)CC2)cn1
InChIInChI=1S/C12H21N5/c1-10(2)15-11-8-14-12(9-13-11)17-6-4-16(3)5-7-17/h8-10H,4-7H2,1-3H3,(H,13,15)
InChIKeyMPVKORYKCAFDLE-UHFFFAOYSA-N
XLogP1.05
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.34
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine
CID 90810476
6-(4-methylpiperazin-1-yl)-4-N-propan-2-ylpyrimidine-2,4-diamine
CID 54585780
2-methyl-N-[[5-(4-methyl-1,4-diazepan-1-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 107379011
5-(4-methylpiperazin-1-yl)pyrazine-2-carboxylic acid;dihydrochloride
CID 170916735
N-(5-pyrrolidin-1-ylpyrazin-2-yl)acetamide
CID 146233118
6-(4-methylpiperazin-1-yl)-2-N-propan-2-ylpyrimidine-2,4-diamine
CID 54587791
N-propan-2-yl-5-pyrrolidin-1-ylpyridin-2-amine
CID 115917830
N-tert-butyl-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278299
(1R)-1-[5-fluoro-2-(4-methylpiperazin-1-yl)-4-pyridinyl]ethanamine
CID 129078090
2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine
CID 58006688
N-[(5-pyrrolidin-1-ylpyrazin-2-yl)methyl]propan-2-amine
CID 107378812
1-(5-bromo-2-pyridinyl)-4-methyl-1,4-diazepane
CID 59292213

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine?
The IUPAC name of 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine (CID 168776208) is 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine.
What is the SMILES notation for 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine?
The canonical SMILES for 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine is CC(C)Nc1cnc(N2CCN(C)CC2)cn1.
What is the InChIKey of 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine?
The InChIKey is MPVKORYKCAFDLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-10(2)15-11-8-14-12(9-13-11)17-6-4-16(3)5-7-17/h8-10H,4-7H2,1-3H3,(H,13,15).
What are the key properties of 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine?
5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine has a molecular weight of 235.34 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine is sourced from PubChem (CID 168776208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).