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

2-Chloro-6-(1-piperazinyl)pyrazine
CID 107992
MK-212 hydrochloride
CID 198421
{3-[4-(3-Diisobutylamino-propyl)-piperazin-1-yl]-propyl}-pyrazin-2-yl-amine
CID 44348813
1,1-Ethanediamine, N,N'-dipyrazinyl-
CID 100791
1-Piperazinylpyrazine
CID 2734639
2-Methyl-3-(piperazin-1-yl)pyrazine
CID 45099710
2-(Piperazin-1-yl)pyrazine hydrochloride
CID 12200486
2-Chloro-5-(piperazin-1-yl)pyrazine hydrochloride
CID 20361688
2-Chloro-3-(piperazin-1-yl)pyrazine hydrochloride
CID 85596812
N-(2-aminoethyl)pyrazin-2-amine
CID 16768175
N-methyl-1-(pyrazin-2-yl)piperidin-4-amine
CID 23215508
N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide
CID 33384005

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).