2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine

C18H24N2O — CID 62440308

IUPAC2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine
SMILESCc1ccc(OCc2ccc(CNC(C)(C)C)cc2)cn1
InChIInChI=1S/C18H24N2O/c1-14-5-10-17(12-19-14)21-13-16-8-6-15(7-9-16)11-20-18(2,3)4/h5-10,12,20H,11,13H2,1-4H3
InChIKeyGVRATFQSBDQLDJ-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.86
Rot. Bonds5

About 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine

2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine (PubChem CID 62440308) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine
PubChem CID62440308
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine
SMILESCc1ccc(OCc2ccc(CNC(C)(C)C)cc2)cn1
InChIInChI=1S/C18H24N2O/c1-14-5-10-17(12-19-14)21-13-16-8-6-15(7-9-16)11-20-18(2,3)4/h5-10,12,20H,11,13H2,1-4H3
InChIKeyGVRATFQSBDQLDJ-UHFFFAOYSA-N
XLogP3.86
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[3-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine
CID 62440301
2-methyl-N-[[6-[(6-methyl-3-pyridinyl)oxymethyl]-2-pyridinyl]methyl]propan-2-amine
CID 106907533
2-methyl-N-[[5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]propan-2-amine
CID 62443200
N-[[3-chloro-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methyl]-2-methylpropan-2-amine
CID 81152126
N-tert-butyl-4-[(6-methyl-3-pyridinyl)oxy]butan-1-amine
CID 55073143
2-methyl-N-[[4-[(4-nitrosophenyl)methoxy]phenyl]methyl]propan-2-amine
CID 89228032
N-[2-[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]ethyl]propan-2-amine
CID 105348799
2-methyl-N-[[4-[(1-methylpyrazol-4-yl)methoxy]phenyl]methyl]propan-2-amine
CID 63061350
N-[[4-[(tert-butylamino)methyl]phenyl]methyl]-2-methylpropan-2-amine
CID 22251747
N-methyl-1-[4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine
CID 55031360
2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine
CID 63069645
2-methyl-N-[[2-[(6-methyl-3-pyridinyl)oxy]-3-pyridinyl]methyl]propan-2-amine
CID 62287354

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine (CID 62440308) is 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine is Cc1ccc(OCc2ccc(CNC(C)(C)C)cc2)cn1.
What is the InChIKey of 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine?
The InChIKey is GVRATFQSBDQLDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-14-5-10-17(12-19-14)21-13-16-8-6-15(7-9-16)11-20-18(2,3)4/h5-10,12,20H,11,13H2,1-4H3.
What are the key properties of 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine?
2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine has a molecular weight of 284.40 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine is sourced from PubChem (CID 62440308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).