N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine

C15H25N3O — CID 62288582

IUPACN-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine
SMILESCCCNCc1cccnc1OC1CCN(C)CC1
InChIInChI=1S/C15H25N3O/c1-3-8-16-12-13-5-4-9-17-15(13)19-14-6-10-18(2)11-7-14/h4-5,9,14,16H,3,6-8,10-12H2,1-2H3
InChIKeyNADJORNETFVUIE-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.05
Rot. Bonds6

About N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine

N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine (PubChem CID 62288582) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine
PubChem CID62288582
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine
SMILESCCCNCc1cccnc1OC1CCN(C)CC1
InChIInChI=1S/C15H25N3O/c1-3-8-16-12-13-5-4-9-17-15(13)19-14-6-10-18(2)11-7-14/h4-5,9,14,16H,3,6-8,10-12H2,1-2H3
InChIKeyNADJORNETFVUIE-UHFFFAOYSA-N
XLogP2.05
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine with MolForge

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Related Compounds

N-[(2-methoxy-3-pyridinyl)methyl]-2-(1-methylpiperidin-4-yl)ethanamine
CID 114515582
N-methyl-N-(1-methylpiperidin-4-yl)-3-(propylaminomethyl)pyridin-2-amine
CID 62279254
N-[[2-(cyclopropylmethoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62292023
N-[[3-fluoro-2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]ethanamine
CID 105390723
N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 62286453
N-[[2-(2-cyclopropylethoxy)-3-pyridinyl]methyl]propan-1-amine
CID 106205338
N-[[2-(4-ethoxypiperidin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 62282809
N-[(2-heptoxy-3-pyridinyl)methyl]propan-1-amine
CID 63490010
N-methyl-1-[2-(4-methylcyclohexyl)oxy-3-pyridinyl]methanamine
CID 62290124
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propan-1-amine
CID 61373669
N-[[6-(1-methylpiperidin-4-yl)oxypyridazin-3-yl]methyl]propan-1-amine
CID 55058469
N-[(2-phenoxy-3-pyridinyl)methyl]propan-1-amine
CID 62295599

Frequently Asked Questions

What is the IUPAC name of N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine?
The IUPAC name of N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine (CID 62288582) is N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine.
What is the SMILES notation for N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine?
The canonical SMILES for N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine is CCCNCc1cccnc1OC1CCN(C)CC1.
What is the InChIKey of N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine?
The InChIKey is NADJORNETFVUIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-3-8-16-12-13-5-4-9-17-15(13)19-14-6-10-18(2)11-7-14/h4-5,9,14,16H,3,6-8,10-12H2,1-2H3.
What are the key properties of N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine?
N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 2.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine is sourced from PubChem (CID 62288582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).