N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine

C16H26N2O2 — CID 79151236

IUPACN-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCc1ccc(OCC2CCOCC2)c(CNC(C)C)n1
InChIInChI=1S/C16H26N2O2/c1-12(2)17-10-15-16(5-4-13(3)18-15)20-11-14-6-8-19-9-7-14/h4-5,12,14,17H,6-11H2,1-3H3
InChIKeyJQMMEAWWHWOATP-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.69
Rot. Bonds6

About N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine

N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 79151236) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
PubChem CID79151236
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCc1ccc(OCC2CCOCC2)c(CNC(C)C)n1
InChIInChI=1S/C16H26N2O2/c1-12(2)17-10-15-16(5-4-13(3)18-15)20-11-14-6-8-19-9-7-14/h4-5,12,14,17H,6-11H2,1-3H3
InChIKeyJQMMEAWWHWOATP-UHFFFAOYSA-N
XLogP2.69
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[3-(cyclopropylmethoxy)-6-methyl-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79159102
N-[[6-methyl-3-(thiophen-2-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79151007
N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 81250738
N-methyl-1-[6-methyl-3-(oxan-4-yloxy)-2-pyridinyl]methanamine
CID 79150869
N-[[2-(oxan-4-ylmethoxy)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 113378047
N-[[4-methoxy-2-(oxan-4-ylmethoxy)phenyl]methyl]propan-2-amine
CID 62385101
2-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]ethanamine
CID 79169642
N-[[6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]-2-pyridinyl]methyl]propan-2-amine
CID 79262670
N-[[6-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methoxy]-2-pyridinyl]methyl]propan-2-amine
CID 79150848
5-[[6-methyl-2-[(propan-2-ylamino)methyl]-3-pyridinyl]oxy]pentanenitrile
CID 79151307
N-[[5-(oxan-4-ylmethoxy)-1,3,4-thiadiazol-2-yl]methyl]propan-2-amine
CID 80620488
N-[(6-methyl-3-pent-4-ynoxy-2-pyridinyl)methyl]propan-2-amine
CID 113374142

Frequently Asked Questions

What is the IUPAC name of N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine (CID 79151236) is N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine is Cc1ccc(OCC2CCOCC2)c(CNC(C)C)n1.
What is the InChIKey of N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is JQMMEAWWHWOATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-12(2)17-10-15-16(5-4-13(3)18-15)20-11-14-6-8-19-9-7-14/h4-5,12,14,17H,6-11H2,1-3H3.
What are the key properties of N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine?
N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine has a molecular weight of 278.40 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 79151236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).