N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine

C14H24N2O2 — CID 79794727

IUPACN-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine
SMILESCOCC(C)Oc1ccc(CNCC(C)C)nc1
InChIInChI=1S/C14H24N2O2/c1-11(2)7-15-8-13-5-6-14(9-16-13)18-12(3)10-17-4/h5-6,9,11-12,15H,7-8,10H2,1-4H3
InChIKeyVFGUAATXKYXYOF-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.24
Rot. Bonds8

About N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine

N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine (PubChem CID 79794727) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine
PubChem CID79794727
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine
SMILESCOCC(C)Oc1ccc(CNCC(C)C)nc1
InChIInChI=1S/C14H24N2O2/c1-11(2)7-15-8-13-5-6-14(9-16-13)18-12(3)10-17-4/h5-6,9,11-12,15H,7-8,10H2,1-4H3
InChIKeyVFGUAATXKYXYOF-UHFFFAOYSA-N
XLogP2.24
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]propan-2-amine
CID 79781881
4-[[6-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]butan-2-ol
CID 113398862
N-[[5-(3-methoxy-3-methylbutoxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 103032855
N-[[5-(3-ethoxypropoxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79794906
N-ethyl-2-[[6-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]acetamide
CID 79793839
N-[[5-(difluoromethoxy)-2-pyridinyl]methyl]-2-methoxyethanamine
CID 79793947
N-[[5-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79788749
2-methyl-N-[[5-[(5-methyloxolan-2-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine
CID 103133309
2-methyl-N-[[5-(2-pyrazol-1-ylethoxy)-2-pyridinyl]methyl]propan-1-amine
CID 79793929
2-methyl-N-[[5-[(2-methyl-1,3-thiazol-5-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine
CID 79793744
2-methoxy-N-[(5-methoxy-2-pyridinyl)methyl]ethanamine
CID 79794826
N-[(5-but-3-en-2-yloxy-2-pyridinyl)methyl]ethanamine
CID 79775993

Frequently Asked Questions

What is the IUPAC name of N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine (CID 79794727) is N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine is COCC(C)Oc1ccc(CNCC(C)C)nc1.
What is the InChIKey of N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine?
The InChIKey is VFGUAATXKYXYOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-11(2)7-15-8-13-5-6-14(9-16-13)18-12(3)10-17-4/h5-6,9,11-12,15H,7-8,10H2,1-4H3.
What are the key properties of N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine?
N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine has a molecular weight of 252.36 g/mol, XLogP of 2.24, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(1-methoxypropan-2-yloxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 79794727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).