2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine

C17H22N4 — CID 71683732

IUPAC2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine
SMILESCc1cccc(N2CCN(c3ccc(N)c(C)n3)CC2)c1
InChIInChI=1S/C17H22N4/c1-13-4-3-5-15(12-13)20-8-10-21(11-9-20)17-7-6-16(18)14(2)19-17/h3-7,12H,8-11,18H2,1-2H3
InChIKeyOOMWRMHYJIAXSZ-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.61
Rot. Bonds2

About 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine

2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine (PubChem CID 71683732) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine
PubChem CID71683732
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC Name2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine
SMILESCc1cccc(N2CCN(c3ccc(N)c(C)n3)CC2)c1
InChIInChI=1S/C17H22N4/c1-13-4-3-5-15(12-13)20-8-10-21(11-9-20)17-7-6-16(18)14(2)19-17/h3-7,12H,8-11,18H2,1-2H3
InChIKeyOOMWRMHYJIAXSZ-UHFFFAOYSA-N
XLogP2.61
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-(3-methylphenyl)piperazin-1-yl]pyridine-2,3-diamine
CID 79827724
2-chloro-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-4-amine
CID 104918819
2-chloro-4-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyrimidine
CID 62477783
1-[4-(5-amino-6-methyl-2-pyridinyl)piperazin-1-yl]ethanone
CID 79020981
1-[4-(5-amino-6-methyl-2-pyridinyl)piperazin-1-yl]-2,2-dimethylpropan-1-one
CID 82331730
4-[4-(3-methylphenyl)piperazin-1-yl]-2-(4-methylpiperazin-1-yl)pyrimidine
CID 112888119
1-(3-methylphenyl)-4-(5-nitro-2-pyridinyl)piperazine
CID 27306784
[6-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]methanol
CID 61252606
3-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 60520649
5-iodo-2-[4-(3-methylphenyl)piperazin-1-yl]aniline
CID 66064668
1-(5-bromo-4-methyl-2-pyridinyl)-4-(3-methylphenyl)piperazine
CID 114870227
1-[4-(5-amino-6-methyl-2-pyridinyl)piperazin-1-yl]propan-1-one
CID 82331726

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine?
The IUPAC name of 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine (CID 71683732) is 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine.
What is the SMILES notation for 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine?
The canonical SMILES for 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine is Cc1cccc(N2CCN(c3ccc(N)c(C)n3)CC2)c1.
What is the InChIKey of 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine?
The InChIKey is OOMWRMHYJIAXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-13-4-3-5-15(12-13)20-8-10-21(11-9-20)17-7-6-16(18)14(2)19-17/h3-7,12H,8-11,18H2,1-2H3.
What are the key properties of 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine?
2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine has a molecular weight of 282.39 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-3-amine is sourced from PubChem (CID 71683732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).