N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine

C16H26N2 — CID 115209429

IUPACN-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine
SMILESCc1ccccc1CCN(C)CC1CCCCN1
InChIInChI=1S/C16H26N2/c1-14-7-3-4-8-15(14)10-12-18(2)13-16-9-5-6-11-17-16/h3-4,7-8,16-17H,5-6,9-13H2,1-2H3
InChIKeySNXAVGDGBMUNKS-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.61
Rot. Bonds5

About N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine

N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine (PubChem CID 115209429) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine
PubChem CID115209429
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC NameN-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine
SMILESCc1ccccc1CCN(C)CC1CCCCN1
InChIInChI=1S/C16H26N2/c1-14-7-3-4-8-15(14)10-12-18(2)13-16-9-5-6-11-17-16/h3-4,7-8,16-17H,5-6,9-13H2,1-2H3
InChIKeySNXAVGDGBMUNKS-UHFFFAOYSA-N
XLogP2.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(azepan-2-yl)-N-methyl-N-[(2-methylphenyl)methyl]methanamine
CID 64569172
N-methyl-N-[[(2R)-piperidin-2-yl]methyl]-2-pyridin-2-ylethanamine
CID 28599674
N-methyl-N-(piperidin-2-ylmethyl)-2-pyridin-3-ylethanamine
CID 106635742
N-methyl-2-pyridin-2-yl-N-[[(2R)-pyrrolidin-2-yl]methyl]ethanamine
CID 28599662
N-methyl-3-phenoxy-N-(piperidin-2-ylmethyl)propan-1-amine
CID 106635115
(2R)-2-[(2-methylphenyl)methyl]pyrrolidine
CID 7047857
2-(5-bromothiophen-2-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 115209420
(E)-N-methyl-3-phenyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine
CID 106635606
N-[(3-chloro-2-fluorophenyl)methyl]-N-methyl-1-piperidin-2-ylmethanamine
CID 106622977
N-methyl-N-[2-(2-methylphenyl)ethyl]-2-morpholin-3-ylethanamine
CID 115239043
2-(4-bromothiophen-2-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 115209426
2-(2,3-dihydro-1-benzofuran-5-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106635582

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine?
The IUPAC name of N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine (CID 115209429) is N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine?
The canonical SMILES for N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine is Cc1ccccc1CCN(C)CC1CCCCN1.
What is the InChIKey of N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine?
The InChIKey is SNXAVGDGBMUNKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-14-7-3-4-8-15(14)10-12-18(2)13-16-9-5-6-11-17-16/h3-4,7-8,16-17H,5-6,9-13H2,1-2H3.
What are the key properties of N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine?
N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine has a molecular weight of 246.40 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylphenyl)-N-(piperidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 115209429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).