4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine

C10H11N3OS — CID 75386240

IUPAC4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine
SMILESCOc1ccncc1NCc1cscn1
InChIInChI=1S/C10H11N3OS/c1-14-10-2-3-11-5-9(10)12-4-8-6-15-7-13-8/h2-3,5-7,12H,4H2,1H3
InChIKeyBOYNPFFWMPFQRE-UHFFFAOYSA-N
MW221.29 g/mol
LogP2.16
Rot. Bonds4

About 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine

4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine (PubChem CID 75386240) has the molecular formula C10H11N3OS and a molecular weight of 221.29 g/mol. Its IUPAC name is 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine.

Molecular Properties

Compound Name4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine
PubChem CID75386240
Molecular FormulaC10H11N3OS
Molecular Weight221.29 g/mol
Exact Mass221.06
IUPAC Name4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine
SMILESCOc1ccncc1NCc1cscn1
InChIInChI=1S/C10H11N3OS/c1-14-10-2-3-11-5-9(10)12-4-8-6-15-7-13-8/h2-3,5-7,12H,4H2,1H3
InChIKeyBOYNPFFWMPFQRE-UHFFFAOYSA-N
XLogP2.16
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.29
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine?
The IUPAC name of 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine (CID 75386240) is 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine.
What is the SMILES notation for 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine?
The canonical SMILES for 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine is COc1ccncc1NCc1cscn1.
What is the InChIKey of 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine?
The InChIKey is BOYNPFFWMPFQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-14-10-2-3-11-5-9(10)12-4-8-6-15-7-13-8/h2-3,5-7,12H,4H2,1H3.
What are the key properties of 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine?
4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine has a molecular weight of 221.29 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine is sourced from PubChem (CID 75386240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).