1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine

C16H26N2O — CID 106623052

IUPAC1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
SMILESCOc1ccccc1C(C)N(C)CC1CCCCN1
InChIInChI=1S/C16H26N2O/c1-13(15-9-4-5-10-16(15)19-3)18(2)12-14-8-6-7-11-17-14/h4-5,9-10,13-14,17H,6-8,11-12H2,1-3H3
InChIKeyVKOHYJMQIXGTHU-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.83
Rot. Bonds5

About 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine

1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine (PubChem CID 106623052) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
PubChem CID106623052
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
SMILESCOc1ccccc1C(C)N(C)CC1CCCCN1
InChIInChI=1S/C16H26N2O/c1-13(15-9-4-5-10-16(15)19-3)18(2)12-14-8-6-7-11-17-14/h4-5,9-10,13-14,17H,6-8,11-12H2,1-3H3
InChIKeyVKOHYJMQIXGTHU-UHFFFAOYSA-N
XLogP2.83
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chlorophenyl)-N-methyl-N-[[(2R)-pyrrolidin-2-yl]methyl]ethanamine
CID 102819503
1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622772
(1S)-1-(furan-2-yl)-N-methyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 97162149
N-[1-(2-ethoxyphenyl)ethyl]-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 106602862
N-methyl-N-(piperidin-2-ylmethyl)-1-pyridin-4-ylethanamine
CID 106623108
N-[1-(2-bromophenyl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106621969
(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine
CID 118327627
2-methoxy-6-[[methyl(piperidin-2-ylmethyl)amino]methyl]phenol
CID 106622828
3-[1-[methyl(piperidin-2-ylmethyl)amino]ethyl]benzonitrile
CID 106623014
N,2-dimethyl-1-phenyl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106602398
2-[2-(2-propan-2-ylphenoxy)ethyl]piperidine
CID 43149996
1-(1,3-benzodioxol-5-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622998

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The IUPAC name of 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine (CID 106623052) is 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine is COc1ccccc1C(C)N(C)CC1CCCCN1.
What is the InChIKey of 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The InChIKey is VKOHYJMQIXGTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13(15-9-4-5-10-16(15)19-3)18(2)12-14-8-6-7-11-17-14/h4-5,9-10,13-14,17H,6-8,11-12H2,1-3H3.
What are the key properties of 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine has a molecular weight of 262.40 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 106623052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).