(1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine

C13H19N3O — CID 139504080

IUPAC(1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine
SMILESCOc1cc(N2C[C@H]3CC[C@H](C2)C3N)ccn1
InChIInChI=1S/C13H19N3O/c1-17-12-6-11(4-5-15-12)16-7-9-2-3-10(8-16)13(9)14/h4-6,9-10,13H,2-3,7-8,14H2,1H3/t9-,10-/m1/s1
InChIKeyMNYDYTOZRQSLAO-NXEZZACHSA-N
MW233.31 g/mol
LogP1.26
Rot. Bonds2

About (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine

(1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine (PubChem CID 139504080) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine.

Molecular Properties

Compound Name(1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine
PubChem CID139504080
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name(1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine
SMILESCOc1cc(N2C[C@H]3CC[C@H](C2)C3N)ccn1
InChIInChI=1S/C13H19N3O/c1-17-12-6-11(4-5-15-12)16-7-9-2-3-10(8-16)13(9)14/h4-6,9-10,13H,2-3,7-8,14H2,1H3/t9-,10-/m1/s1
InChIKeyMNYDYTOZRQSLAO-NXEZZACHSA-N
XLogP1.26
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine with MolForge

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

Launch Full Analysis

Related Compounds

4-(3-chloro-4-methylpiperidin-1-yl)-2-methoxypyridine
CID 102960739
2-[1-(2-methoxy-4-pyridinyl)azetidin-3-yl]propanoic acid
CID 116682028
lithium 2-[1-(2-methoxy-4-pyridinyl)azetidin-3-yl]acetate
CID 171808777
4-[3-(2-chloroethyl)pyrrolidin-1-yl]-2-methoxypyridine
CID 114800882
N-tert-butyl-1-(2-methoxy-4-pyridinyl)azetidine-3-carboxamide
CID 166602186
3-bromo-5-(3-chlorophenoxy)-1-(2,2,2-trifluoroethyl)-1,2,4-triazole;8-[[5-(3-chlorophenoxy)-1-(2,2,2-trifluoroethyl)-1,2,4-triazol-3-yl]methyl]-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octane;3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine
CID 161340937
1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine
CID 107110261
[1-(2-methoxy-4-pyridinyl)-4-methylpiperidin-4-yl]methanamine
CID 107160457
4-[4-(2-bromoethoxy)piperidin-1-yl]-2-methoxypyridine
CID 82701054
(1R,5S)-3-(2-methylpyrimidin-4-yl)-3-azabicyclo[3.2.1]octan-8-amine
CID 129232027
1-(2-methoxy-4-pyridinyl)-3-methylpyrrolidin-3-ol
CID 103357727
(1R,5R)-N-[5-(2-chlorophenoxy)-1-propan-2-yl-1,2,4-triazol-3-yl]-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine
CID 166781646

Frequently Asked Questions

What is the IUPAC name of (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine?
The IUPAC name of (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine (CID 139504080) is (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine.
What is the SMILES notation for (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine?
The canonical SMILES for (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine is COc1cc(N2C[C@H]3CC[C@H](C2)C3N)ccn1.
What is the InChIKey of (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine?
The InChIKey is MNYDYTOZRQSLAO-NXEZZACHSA-N. The full InChI is InChI=1S/C13H19N3O/c1-17-12-6-11(4-5-15-12)16-7-9-2-3-10(8-16)13(9)14/h4-6,9-10,13H,2-3,7-8,14H2,1H3/t9-,10-/m1/s1.
What are the key properties of (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine?
(1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine has a molecular weight of 233.31 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5R)-3-(2-methoxy-4-pyridinyl)-3-azabicyclo[3.2.1]octan-8-amine is sourced from PubChem (CID 139504080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).