N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine

C12H20N4 — CID 116956735

IUPACN-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine
SMILESCNC(c1ccncc1)C1CN(C)CCN1
InChIInChI=1S/C12H20N4/c1-13-12(10-3-5-14-6-4-10)11-9-16(2)8-7-15-11/h3-6,11-13,15H,7-9H2,1-2H3
InChIKeySFNBNMPJGMPXQX-UHFFFAOYSA-N
MW220.32 g/mol
LogP0.25
Rot. Bonds3

About N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine

N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine (PubChem CID 116956735) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine
PubChem CID116956735
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine
SMILESCNC(c1ccncc1)C1CN(C)CCN1
InChIInChI=1S/C12H20N4/c1-13-12(10-3-5-14-6-4-10)11-9-16(2)8-7-15-11/h3-6,11-13,15H,7-9H2,1-2H3
InChIKeySFNBNMPJGMPXQX-UHFFFAOYSA-N
XLogP0.25
TPSA40.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-bromophenyl)-N-methyl-1-(4-methylpiperazin-2-yl)methanamine
CID 116956697
N-methyl-1-(4-methylpiperazin-2-yl)-1-(2,4,5-trimethylphenyl)methanamine
CID 116956720
N,N-dimethyl-1-(4-methylpiperazin-2-yl)-1-pyridin-2-ylmethanamine
CID 116911018
(4-methylphenyl)-(4-methylpiperazin-2-yl)methanamine
CID 116941344
N-methyl-4-[methylamino(pyridin-4-yl)methyl]cyclohexan-1-amine
CID 116952366
1-(4-methylpiperazin-2-yl)ethanamine
CID 116941341
(3,4-dimethylphenyl)-(4-methylpiperazin-2-yl)methanamine
CID 116941348
2-[(4-methylpiperazin-2-yl)methyl]-4-pyridin-4-ylpyrimidine
CID 116901944
(6-methylnaphthalen-2-yl)-(4-methylpiperazin-2-yl)methanamine
CID 116941438
N-methyl-2-piperazin-1-yl-1-pyridin-4-ylpropan-1-amine
CID 116960994
4-methyl-2-(4-methylpiperazin-2-yl)-6-pyridin-4-ylpyrimidine
CID 116895618
(2-methyl-3H-benzimidazol-5-yl)-(4-methylpiperazin-2-yl)methanamine
CID 116941411

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine?
The IUPAC name of N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine (CID 116956735) is N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine.
What is the SMILES notation for N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine?
The canonical SMILES for N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine is CNC(c1ccncc1)C1CN(C)CCN1.
What is the InChIKey of N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine?
The InChIKey is SFNBNMPJGMPXQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-13-12(10-3-5-14-6-4-10)11-9-16(2)8-7-15-11/h3-6,11-13,15H,7-9H2,1-2H3.
What are the key properties of N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine?
N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine has a molecular weight of 220.32 g/mol, XLogP of 0.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methylpiperazin-2-yl)-1-pyridin-4-ylmethanamine is sourced from PubChem (CID 116956735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).