N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine

C18H24N2O3 — CID 662771

IUPACN-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine
SMILESCOc1ccc(CN(C)CCc2ccccn2)c(OC)c1OC
InChIInChI=1S/C18H24N2O3/c1-20(12-10-15-7-5-6-11-19-15)13-14-8-9-16(21-2)18(23-4)17(14)22-3/h5-9,11H,10,12-13H2,1-4H3
InChIKeyYZZZJXNSZPTDHU-UHFFFAOYSA-N
MW316.40 g/mol
LogP2.78
Rot. Bonds8

About N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine

N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine (PubChem CID 662771) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine
PubChem CID662771
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC NameN-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine
SMILESCOc1ccc(CN(C)CCc2ccccn2)c(OC)c1OC
InChIInChI=1S/C18H24N2O3/c1-20(12-10-15-7-5-6-11-19-15)13-14-8-9-16(21-2)18(23-4)17(14)22-3/h5-9,11H,10,12-13H2,1-4H3
InChIKeyYZZZJXNSZPTDHU-UHFFFAOYSA-N
XLogP2.78
TPSA43.82 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-3-[[methyl(2-pyridin-2-ylethyl)amino]methyl]aniline
CID 43247155
3-methoxy-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]aniline
CID 107208208
N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine
CID 779150
2-iodo-6-methoxy-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]phenol
CID 4662476
2-methyl-1-(2-pyridin-2-ylethyl)-3-[2-(2,3,4-trimethoxyphenyl)ethyl]guanidine;hydroiodide
CID 111192179
N-methyl-2-pyridin-2-yl-N-(pyridin-2-ylmethyl)ethanamine;oxalic acid
CID 2845946
4-chloro-2,6-bis[[methyl(2-pyridin-2-ylethyl)amino]methyl]phenol
CID 139202506
N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 21307320
3-methoxy-4-[[methyl(pyridin-2-ylmethyl)amino]methyl]aniline
CID 107208235
N-benzyl-N-methyl-2-pyridin-2-ylethanamine;oxalic acid
CID 17384893
3-fluoro-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]benzoic acid
CID 63069441
N-methyl-2-pyridin-2-yl-N-(pyridin-3-ylmethyl)ethanamine
CID 2055754

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine?
The IUPAC name of N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine (CID 662771) is N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine.
What is the SMILES notation for N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine?
The canonical SMILES for N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine is COc1ccc(CN(C)CCc2ccccn2)c(OC)c1OC.
What is the InChIKey of N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine?
The InChIKey is YZZZJXNSZPTDHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-20(12-10-15-7-5-6-11-19-15)13-14-8-9-16(21-2)18(23-4)17(14)22-3/h5-9,11H,10,12-13H2,1-4H3.
What are the key properties of N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine?
N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine has a molecular weight of 316.40 g/mol, XLogP of 2.78, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine is sourced from PubChem (CID 662771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).