N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine

C15H23N3O — CID 62288585

IUPACN-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine
SMILESCN1CCC(Oc2ccnc(CNC3CC3)c2)CC1
InChIInChI=1S/C15H23N3O/c1-18-8-5-14(6-9-18)19-15-4-7-16-13(10-15)11-17-12-2-3-12/h4,7,10,12,14,17H,2-3,5-6,8-9,11H2,1H3
InChIKeyYYIFEIBACGZOOG-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.81
Rot. Bonds5

About N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine

N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine (PubChem CID 62288585) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine
PubChem CID62288585
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine
SMILESCN1CCC(Oc2ccnc(CNC3CC3)c2)CC1
InChIInChI=1S/C15H23N3O/c1-18-8-5-14(6-9-18)19-15-4-7-16-13(10-15)11-17-12-2-3-12/h4,7,10,12,14,17H,2-3,5-6,8-9,11H2,1H3
InChIKeyYYIFEIBACGZOOG-UHFFFAOYSA-N
XLogP1.81
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine (CID 62288585) is N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine is CN1CCC(Oc2ccnc(CNC3CC3)c2)CC1.
What is the InChIKey of N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine?
The InChIKey is YYIFEIBACGZOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-18-8-5-14(6-9-18)19-15-4-7-16-13(10-15)11-17-12-2-3-12/h4,7,10,12,14,17H,2-3,5-6,8-9,11H2,1H3.
What are the key properties of N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine?
N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine has a molecular weight of 261.37 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 62288585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).