1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine

C16H21N3O — CID 103175609

IUPAC1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine
SMILESCCc1nc(C)ccc1OCc1ccc(CNC)cn1
InChIInChI=1S/C16H21N3O/c1-4-15-16(8-5-12(2)19-15)20-11-14-7-6-13(9-17-3)10-18-14/h5-8,10,17H,4,9,11H2,1-3H3
InChIKeyNHDDNRUEHONLLS-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.65
Rot. Bonds6

About 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine

1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine (PubChem CID 103175609) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine
PubChem CID103175609
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine
SMILESCCc1nc(C)ccc1OCc1ccc(CNC)cn1
InChIInChI=1S/C16H21N3O/c1-4-15-16(8-5-12(2)19-15)20-11-14-7-6-13(9-17-3)10-18-14/h5-8,10,17H,4,9,11H2,1-3H3
InChIKeyNHDDNRUEHONLLS-UHFFFAOYSA-N
XLogP2.65
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine with MolForge

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Related Compounds

1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine
CID 103175544
1-[3-[(4-methoxyphenyl)methoxy]-6-methyl-2-pyridinyl]-N-methylmethanamine
CID 79150973
1-[2-ethyl-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-4-pyridinyl]-N-methylmethanamine
CID 103175494
[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]phenyl]methanol
CID 103175335
1-[3-[(3,4-difluorophenyl)methoxy]-6-methyl-2-pyridinyl]-N-methylmethanamine
CID 82918461
N-methyl-1-[6-methyl-3-(pyrimidin-2-ylmethoxy)-2-pyridinyl]methanamine
CID 79150580
1-[4-methoxy-3-[(6-methyl-2-pyridinyl)methoxy]phenyl]-N-methylmethanamine
CID 79267227
N-methyl-1-[6-methyl-3-[(4-nitrophenyl)methoxy]-2-pyridinyl]methanamine
CID 79157121
N-methyl-1-(6-propyl-3-pyridinyl)methanamine
CID 142021922
2-(bromomethyl)-3-[(4-ethylphenyl)methoxy]-6-methylpyridine
CID 79169382
1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]-N-methylmethanamine
CID 103175444
[4-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-2-yl]methanamine
CID 103175647

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine (CID 103175609) is 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine is CCc1nc(C)ccc1OCc1ccc(CNC)cn1.
What is the InChIKey of 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine?
The InChIKey is NHDDNRUEHONLLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-4-15-16(8-5-12(2)19-15)20-11-14-7-6-13(9-17-3)10-18-14/h5-8,10,17H,4,9,11H2,1-3H3.
What are the key properties of 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine?
1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine has a molecular weight of 271.36 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 103175609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).