N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine

C13H21N3 — CID 116956619

IUPACN-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine
SMILESCNC(c1ccccc1)C1CNCCN1C
InChIInChI=1S/C13H21N3/c1-14-13(11-6-4-3-5-7-11)12-10-15-8-9-16(12)2/h3-7,12-15H,8-10H2,1-2H3
InChIKeyOLTFGOPGWYIBJR-UHFFFAOYSA-N
MW219.33 g/mol
LogP0.85
Rot. Bonds3

About N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine

N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine (PubChem CID 116956619) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine
PubChem CID116956619
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine
SMILESCNC(c1ccccc1)C1CNCCN1C
InChIInChI=1S/C13H21N3/c1-14-13(11-6-4-3-5-7-11)12-10-15-8-9-16(12)2/h3-7,12-15H,8-10H2,1-2H3
InChIKeyOLTFGOPGWYIBJR-UHFFFAOYSA-N
XLogP0.85
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine
CID 67869065
1-(3H-benzimidazol-5-yl)-N-methyl-1-(1-methylpiperazin-2-yl)methanamine
CID 116956654
(3-methylphenyl)-(1-methylpiperazin-2-yl)methanamine
CID 116941309
(2-methylphenyl)-(1-methylpiperazin-2-yl)methanamine
CID 116941308
(1-methylpiperazin-2-yl)-(1H-pyrrol-3-yl)methanamine
CID 116941283
(2-methyl-1H-indol-3-yl)-(1-methylpiperazin-2-yl)methanamine
CID 116941281
N-methyl-1-(3-methylphenyl)-2-(1-methylpiperazin-2-yl)ethanamine
CID 116956962
1-(3-methoxyphenyl)-N,N-dimethyl-1-(1-methylpiperazin-2-yl)methanamine
CID 116910975
N-methyl-2-(1-methylpiperazin-2-yl)-1-pyridin-3-ylethanamine
CID 116956967
(1R)-N-methyl-1-phenyl-1-[(2S)-pyrrolidin-2-yl]methanamine
CID 132599012
1-(1-phenylpiperazin-2-yl)ethanol
CID 70356757
1-(2-methoxyphenyl)-N-methyl-2-(1-methylpiperazin-2-yl)ethanamine
CID 116956969

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine?
The IUPAC name of N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine (CID 116956619) is N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine.
What is the SMILES notation for N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine?
The canonical SMILES for N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine is CNC(c1ccccc1)C1CNCCN1C.
What is the InChIKey of N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine?
The InChIKey is OLTFGOPGWYIBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-14-13(11-6-4-3-5-7-11)12-10-15-8-9-16(12)2/h3-7,12-15H,8-10H2,1-2H3.
What are the key properties of N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine?
N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine has a molecular weight of 219.33 g/mol, XLogP of 0.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine is sourced from PubChem (CID 116956619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).