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

C13H22N4 — CID 90810476

IUPAC5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine
SMILESCC(C)Nc1ccc(N2CCN(C)CC2)cn1
InChIInChI=1S/C13H22N4/c1-11(2)15-13-5-4-12(10-14-13)17-8-6-16(3)7-9-17/h4-5,10-11H,6-9H2,1-3H3,(H,14,15)
InChIKeyYOAYKNBTEQTNCK-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.65
Rot. Bonds3

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

5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine (PubChem CID 90810476) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine
PubChem CID90810476
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine
SMILESCC(C)Nc1ccc(N2CCN(C)CC2)cn1
InChIInChI=1S/C13H22N4/c1-11(2)15-13-5-4-12(10-14-13)17-8-6-16(3)7-9-17/h4-5,10-11H,6-9H2,1-3H3,(H,14,15)
InChIKeyYOAYKNBTEQTNCK-UHFFFAOYSA-N
XLogP1.65
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-propan-2-yl-5-pyrrolidin-1-ylpyridin-2-amine
CID 115917830
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]hydroxylamine
CID 142567302
5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyrazin-2-amine
CID 168776208
2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide
CID 47215724
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propane-1-sulfonamide
CID 113025882
1-(6-chloro-3-pyridinyl)-4-methylpiperazine
CID 75355748
1-(6-butan-2-yl-3-pyridinyl)-4-methylpiperazine
CID 139538940
(1S)-2,2-dichloro-1-methyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]cyclopropane-1-carboxamide
CID 94146394
2,6-difluoro-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]benzamide
CID 86992589
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]thieno[3,2-d]pyrimidin-2-amine
CID 151602434
N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine
CID 171350063
2-methyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
CID 113025926

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine?
The IUPAC name of 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine (CID 90810476) is 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine is CC(C)Nc1ccc(N2CCN(C)CC2)cn1.
What is the InChIKey of 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine?
The InChIKey is YOAYKNBTEQTNCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-11(2)15-13-5-4-12(10-14-13)17-8-6-16(3)7-9-17/h4-5,10-11H,6-9H2,1-3H3,(H,14,15).
What are the key properties of 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine?
5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine has a molecular weight of 234.35 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 90810476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).