2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine

C11H14N4O — CID 43721974

IUPAC2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine
SMILESCOc1ncccc1NCc1ccnn1C
InChIInChI=1S/C11H14N4O/c1-15-9(5-7-14-15)8-13-10-4-3-6-12-11(10)16-2/h3-7,13H,8H2,1-2H3
InChIKeyPNKBJTXFKUECPN-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.44
Rot. Bonds4

About 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine

2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine (PubChem CID 43721974) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine
PubChem CID43721974
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine
SMILESCOc1ncccc1NCc1ccnn1C
InChIInChI=1S/C11H14N4O/c1-15-9(5-7-14-15)8-13-10-4-3-6-12-11(10)16-2/h3-7,13H,8H2,1-2H3
InChIKeyPNKBJTXFKUECPN-UHFFFAOYSA-N
XLogP1.44
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine?
The IUPAC name of 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine (CID 43721974) is 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine?
The canonical SMILES for 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine is COc1ncccc1NCc1ccnn1C.
What is the InChIKey of 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine?
The InChIKey is PNKBJTXFKUECPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15-9(5-7-14-15)8-13-10-4-3-6-12-11(10)16-2/h3-7,13H,8H2,1-2H3.
What are the key properties of 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine?
2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine has a molecular weight of 218.26 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 43721974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).