2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine

C16H26N2O2 — CID 103133309

IUPAC2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine
SMILESCC(C)CNCc1ccc(OCC2CCC(C)O2)cn1
InChIInChI=1S/C16H26N2O2/c1-12(2)8-17-9-14-5-7-15(10-18-14)19-11-16-6-4-13(3)20-16/h5,7,10,12-13,16-17H,4,6,8-9,11H2,1-3H3
InChIKeyISPDDKMISUTFRA-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.77
Rot. Bonds7

About 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine

2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine (PubChem CID 103133309) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine
PubChem CID103133309
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine
SMILESCC(C)CNCc1ccc(OCC2CCC(C)O2)cn1
InChIInChI=1S/C16H26N2O2/c1-12(2)8-17-9-14-5-7-15(10-18-14)19-11-16-6-4-13(3)20-16/h5,7,10,12-13,16-17H,4,6,8-9,11H2,1-3H3
InChIKeyISPDDKMISUTFRA-UHFFFAOYSA-N
XLogP2.77
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[5-(oxolan-2-ylmethoxy)-2-pyridinyl]methyl]propan-1-amine
CID 79794373
1-[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]propan-2-amine
CID 103136650
N-[[5-(3-ethoxypropoxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79794906
N-[[5-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79788749
(1S)-1-[4-[(5-methyloxolan-2-yl)methoxy]phenyl]ethanamine
CID 103133228
N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79794727
4-[[6-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]butan-2-ol
CID 113398862
N-cyclopropyl-3-[[6-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide
CID 79788776
N-ethyl-1-[4-[(5-methyloxolan-2-yl)methoxy]phenyl]ethanamine
CID 103132895
2-methyl-N-[[5-[(2-methyl-1,3-thiazol-5-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine
CID 79793744
2-methyl-N-[[5-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine
CID 79794903
N-methyl-1-[4-[(5-methyloxolan-2-yl)methoxy]phenyl]methanamine
CID 103132805

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine (CID 103133309) is 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine is CC(C)CNCc1ccc(OCC2CCC(C)O2)cn1.
What is the InChIKey of 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine?
The InChIKey is ISPDDKMISUTFRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-12(2)8-17-9-14-5-7-15(10-18-14)19-11-16-6-4-13(3)20-16/h5,7,10,12-13,16-17H,4,6,8-9,11H2,1-3H3.
What are the key properties of 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine?
2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine has a molecular weight of 278.40 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine is sourced from PubChem (CID 103133309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).