N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine

C15H24N2O — CID 63935693

IUPACN-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine
SMILESCCCNC(c1cccc(C)n1)C1CCOCC1
InChIInChI=1S/C15H24N2O/c1-3-9-16-15(13-7-10-18-11-8-13)14-6-4-5-12(2)17-14/h4-6,13,15-16H,3,7-11H2,1-2H3
InChIKeyHHCZHPABOGBUMD-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.86
Rot. Bonds5

About N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine

N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine (PubChem CID 63935693) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine
PubChem CID63935693
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine
SMILESCCCNC(c1cccc(C)n1)C1CCOCC1
InChIInChI=1S/C15H24N2O/c1-3-9-16-15(13-7-10-18-11-8-13)14-6-4-5-12(2)17-14/h4-6,13,15-16H,3,7-11H2,1-2H3
InChIKeyHHCZHPABOGBUMD-UHFFFAOYSA-N
XLogP2.86
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-ethylcyclohexyl)-(6-methyl-2-pyridinyl)methyl]propan-1-amine
CID 63861308
N-[(3-bromo-2-methylphenyl)-(oxan-4-yl)methyl]propan-1-amine
CID 115855832
N-[oxan-4-yl(pyridazin-4-yl)methyl]propan-1-amine
CID 105147199
N-[(2-bromo-3-fluorophenyl)-(oxan-4-yl)methyl]propan-1-amine
CID 115855854
N-[(3-bromo-2-chlorophenyl)-(oxan-4-yl)methyl]propan-1-amine
CID 115856015
N-[oxan-4-yl(quinolin-3-yl)methyl]propan-1-amine
CID 65334716
N-[(5-ethylfuran-2-yl)-(oxan-4-yl)methyl]propan-1-amine
CID 62906032
N-[oxan-4-yl-[2-(trifluoromethyl)phenyl]methyl]propan-1-amine
CID 65334774
N-[(2-ethylpyrazol-3-yl)-(oxan-4-yl)methyl]propan-1-amine
CID 65334450
N-[(3-bromo-4-methylphenyl)-(oxan-4-yl)methyl]propan-1-amine
CID 115856010
N-[oxan-4-yl(quinolin-4-yl)methyl]propan-1-amine
CID 105147197
N-[(2,3-dimethoxyphenyl)-(oxan-4-yl)methyl]propan-1-amine
CID 105147214

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine?
The IUPAC name of N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine (CID 63935693) is N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine?
The canonical SMILES for N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine is CCCNC(c1cccc(C)n1)C1CCOCC1.
What is the InChIKey of N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine?
The InChIKey is HHCZHPABOGBUMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-9-16-15(13-7-10-18-11-8-13)14-6-4-5-12(2)17-14/h4-6,13,15-16H,3,7-11H2,1-2H3.
What are the key properties of N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine?
N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-2-pyridinyl)-(oxan-4-yl)methyl]propan-1-amine is sourced from PubChem (CID 63935693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).