5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine

C11H16ClN3O — CID 90209549

IUPAC5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine
SMILESCN1CCC(Oc2c(N)cncc2Cl)CC1
InChIInChI=1S/C11H16ClN3O/c1-15-4-2-8(3-5-15)16-11-9(12)6-14-7-10(11)13/h6-8H,2-5,13H2,1H3
InChIKeyLSMRRXWMQMQCQD-UHFFFAOYSA-N
MW241.72 g/mol
LogP1.79
Rot. Bonds2

About 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine

5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine (PubChem CID 90209549) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine.

Molecular Properties

Compound Name5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine
PubChem CID90209549
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine
SMILESCN1CCC(Oc2c(N)cncc2Cl)CC1
InChIInChI=1S/C11H16ClN3O/c1-15-4-2-8(3-5-15)16-11-9(12)6-14-7-10(11)13/h6-8H,2-5,13H2,1H3
InChIKeyLSMRRXWMQMQCQD-UHFFFAOYSA-N
XLogP1.79
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine?
The IUPAC name of 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine (CID 90209549) is 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine.
What is the SMILES notation for 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine?
The canonical SMILES for 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine is CN1CCC(Oc2c(N)cncc2Cl)CC1.
What is the InChIKey of 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine?
The InChIKey is LSMRRXWMQMQCQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-15-4-2-8(3-5-15)16-11-9(12)6-14-7-10(11)13/h6-8H,2-5,13H2,1H3.
What are the key properties of 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine?
5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine has a molecular weight of 241.72 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(1-methylpiperidin-4-yl)oxypyridin-3-amine is sourced from PubChem (CID 90209549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).