N-(azetidin-3-yl)-5-methoxypyridin-2-amine

C9H13N3O — CID 106504454

IUPACN-(azetidin-3-yl)-5-methoxypyridin-2-amine
SMILESCOc1ccc(NC2CNC2)nc1
InChIInChI=1S/C9H13N3O/c1-13-8-2-3-9(11-6-8)12-7-4-10-5-7/h2-3,6-7,10H,4-5H2,1H3,(H,11,12)
InChIKeyGLWRFCZHTHKLEQ-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.47
Rot. Bonds3

About N-(azetidin-3-yl)-5-methoxypyridin-2-amine

N-(azetidin-3-yl)-5-methoxypyridin-2-amine (PubChem CID 106504454) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is N-(azetidin-3-yl)-5-methoxypyridin-2-amine.

Molecular Properties

Compound NameN-(azetidin-3-yl)-5-methoxypyridin-2-amine
PubChem CID106504454
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC NameN-(azetidin-3-yl)-5-methoxypyridin-2-amine
SMILESCOc1ccc(NC2CNC2)nc1
InChIInChI=1S/C9H13N3O/c1-13-8-2-3-9(11-6-8)12-7-4-10-5-7/h2-3,6-7,10H,4-5H2,1H3,(H,11,12)
InChIKeyGLWRFCZHTHKLEQ-UHFFFAOYSA-N
XLogP0.47
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-5-methoxypyridin-2-amine
CID 106503930
1-N-(5-methoxy-2-pyridinyl)cyclobutane-1,3-diamine
CID 106504373
N-(azetidin-3-yl)-5-methoxypyrimidin-2-amine
CID 114600963
N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine
CID 107875130
N-(azetidin-3-yl)-5-(4-methoxyphenyl)pyrimidin-2-amine
CID 116974653
N-(1,1-dioxothiolan-3-yl)-5-methoxypyridin-2-amine
CID 106503952
N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine
CID 114280857
N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine
CID 66331245
6-[[1-(4-methoxyphenyl)piperidin-4-yl]amino]pyridine-3-carbaldehyde
CID 167863799
N-cyclopropyl-N'-(5-methoxy-2-pyridinyl)propane-1,3-diamine
CID 106504375
5-methyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 68833864
6-(cyclopentylamino)-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109152174

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-5-methoxypyridin-2-amine?
The IUPAC name of N-(azetidin-3-yl)-5-methoxypyridin-2-amine (CID 106504454) is N-(azetidin-3-yl)-5-methoxypyridin-2-amine.
What is the SMILES notation for N-(azetidin-3-yl)-5-methoxypyridin-2-amine?
The canonical SMILES for N-(azetidin-3-yl)-5-methoxypyridin-2-amine is COc1ccc(NC2CNC2)nc1.
What is the InChIKey of N-(azetidin-3-yl)-5-methoxypyridin-2-amine?
The InChIKey is GLWRFCZHTHKLEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-13-8-2-3-9(11-6-8)12-7-4-10-5-7/h2-3,6-7,10H,4-5H2,1H3,(H,11,12).
What are the key properties of N-(azetidin-3-yl)-5-methoxypyridin-2-amine?
N-(azetidin-3-yl)-5-methoxypyridin-2-amine has a molecular weight of 179.22 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-5-methoxypyridin-2-amine is sourced from PubChem (CID 106504454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).