[2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine

C13H22N4 — CID 113381278

IUPAC[2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine
SMILESCCc1cc(CN)cc(N2CCN(C)CC2)n1
InChIInChI=1S/C13H22N4/c1-3-12-8-11(10-14)9-13(15-12)17-6-4-16(2)5-7-17/h8-9H,3-7,10,14H2,1-2H3
InChIKeyFCLRTEZHXMEIBB-UHFFFAOYSA-N
MW234.35 g/mol
LogP0.85
Rot. Bonds3

About [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine

[2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine (PubChem CID 113381278) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine
PubChem CID113381278
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name[2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine
SMILESCCc1cc(CN)cc(N2CCN(C)CC2)n1
InChIInChI=1S/C13H22N4/c1-3-12-8-11(10-14)9-13(15-12)17-6-4-16(2)5-7-17/h8-9H,3-7,10,14H2,1-2H3
InChIKeyFCLRTEZHXMEIBB-UHFFFAOYSA-N
XLogP0.85
TPSA45.39 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 ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(4-methylpiperazin-1-yl)-6-propyl-4-pyridinyl]methanamine
CID 113381277
[2-ethyl-6-(1-oxo-1,4-thiazinan-4-yl)-4-pyridinyl]methanamine
CID 113381383
(2,6-diethyl-4-pyridinyl)methanamine
CID 139559204
1-[2-(azepan-1-yl)-6-ethyl-4-pyridinyl]-N-methylmethanamine
CID 113381283
1-methyl-4-(4-propyl-2-pyridinyl)piperazine
CID 145392081
[6-(4-methyl-1,4-diazepan-1-yl)-2-pyridinyl]methanamine
CID 62300509
(E)-but-2-enedioic acid;1-(6-ethyl-4-thiophen-3-yl-2-pyridinyl)-4-methylpiperazine
CID 68620754
[1-[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]piperidin-3-yl]methanol
CID 113380422
6,7-diethoxy-3-(4-methylpiperazin-1-yl)isoquinoline
CID 945660
1-[4-(aminomethyl)-6-methyl-2-pyridinyl]pyrrolidine-3,4-diol
CID 106667672
4-(4-methylpiperazin-1-yl)-6-pyrrolidin-1-ylpyridin-2-amine
CID 53233904
4-(dimethoxymethyl)-2-ethoxy-6-(4-methylpiperazin-1-yl)pyrimidine
CID 138491809

Frequently Asked Questions

What is the IUPAC name of [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine?
The IUPAC name of [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine (CID 113381278) is [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine?
The canonical SMILES for [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine is CCc1cc(CN)cc(N2CCN(C)CC2)n1.
What is the InChIKey of [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine?
The InChIKey is FCLRTEZHXMEIBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-3-12-8-11(10-14)9-13(15-12)17-6-4-16(2)5-7-17/h8-9H,3-7,10,14H2,1-2H3.
What are the key properties of [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine?
[2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine has a molecular weight of 234.35 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-6-(4-methylpiperazin-1-yl)-4-pyridinyl]methanamine is sourced from PubChem (CID 113381278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).