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

C16H20N4 — CID 62299639

IUPAC[6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine
SMILESNCc1cccc(N2CCN(c3ccccc3)CC2)n1
InChIInChI=1S/C16H20N4/c17-13-14-5-4-8-16(18-14)20-11-9-19(10-12-20)15-6-2-1-3-7-15/h1-8H,9-13,17H2
InChIKeyMTFSTIYQPGZBTH-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.87
Rot. Bonds3

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

[6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine (PubChem CID 62299639) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine
PubChem CID62299639
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name[6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine
SMILESNCc1cccc(N2CCN(c3ccccc3)CC2)n1
InChIInChI=1S/C16H20N4/c17-13-14-5-4-8-16(18-14)20-11-9-19(10-12-20)15-6-2-1-3-7-15/h1-8H,9-13,17H2
InChIKeyMTFSTIYQPGZBTH-UHFFFAOYSA-N
XLogP1.87
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanol
CID 62254100
[6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine
CID 62300156
(6-thiomorpholin-4-yl-2-pyridinyl)methanamine
CID 62300518
[6-(4-methyl-1,4-diazepan-1-yl)-2-pyridinyl]methanamine
CID 62300509
4-[4-[6-(2-methylpropyl)-2-pyridinyl]piperazin-1-yl]aniline
CID 90905369
[6-(4-methylsulfanylazepan-1-yl)-2-pyridinyl]methanamine
CID 114236488
1-[6-(aminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
CID 63168924
[6-(2,6-dimethylmorpholin-4-yl)-2-pyridinyl]methanamine
CID 62299451
2-methyl-3-(6-morpholin-4-yl-2-pyridinyl)propan-1-amine
CID 83896771
2-benzyl-4-(4-phenylpiperazin-1-yl)pyrimidine
CID 136521532
(4-phenylpiperazin-1-yl)-(6-pyrrolidin-1-yl-2-pyridinyl)methanone
CID 84573598
[6-[4-(2-chlorophenyl)piperazin-1-yl]-2-pyridinyl]methanol
CID 62254104

Frequently Asked Questions

What is the IUPAC name of [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine?
The IUPAC name of [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine (CID 62299639) is [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine?
The canonical SMILES for [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine is NCc1cccc(N2CCN(c3ccccc3)CC2)n1.
What is the InChIKey of [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine?
The InChIKey is MTFSTIYQPGZBTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c17-13-14-5-4-8-16(18-14)20-11-9-19(10-12-20)15-6-2-1-3-7-15/h1-8H,9-13,17H2.
What are the key properties of [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine?
[6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine has a molecular weight of 268.36 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-phenylpiperazin-1-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 62299639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).