6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine

C14H19N5OS — CID 146425111

IUPAC6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine
SMILESCc1cnc(Nc2cc(CN3CCOCC3)cc(N)n2)s1
InChIInChI=1S/C14H19N5OS/c1-10-8-16-14(21-10)18-13-7-11(6-12(15)17-13)9-19-2-4-20-5-3-19/h6-8H,2-5,9H2,1H3,(H3,15,16,17,18)
InChIKeyIPJKHORFUDKJBF-UHFFFAOYSA-N
MW305.41 g/mol
LogP2.00
Rot. Bonds4

About 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine

6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine (PubChem CID 146425111) has the molecular formula C14H19N5OS and a molecular weight of 305.41 g/mol. Its IUPAC name is 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine
PubChem CID146425111
Molecular FormulaC14H19N5OS
Molecular Weight305.41 g/mol
Exact Mass305.13
IUPAC Name6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine
SMILESCc1cnc(Nc2cc(CN3CCOCC3)cc(N)n2)s1
InChIInChI=1S/C14H19N5OS/c1-10-8-16-14(21-10)18-13-7-11(6-12(15)17-13)9-19-2-4-20-5-3-19/h6-8H,2-5,9H2,1H3,(H3,15,16,17,18)
InChIKeyIPJKHORFUDKJBF-UHFFFAOYSA-N
XLogP2.00
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.41
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine?
The IUPAC name of 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine (CID 146425111) is 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine.
What is the SMILES notation for 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine?
The canonical SMILES for 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine is Cc1cnc(Nc2cc(CN3CCOCC3)cc(N)n2)s1.
What is the InChIKey of 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine?
The InChIKey is IPJKHORFUDKJBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5OS/c1-10-8-16-14(21-10)18-13-7-11(6-12(15)17-13)9-19-2-4-20-5-3-19/h6-8H,2-5,9H2,1H3,(H3,15,16,17,18).
What are the key properties of 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine?
6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine has a molecular weight of 305.41 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(5-methyl-1,3-thiazol-2-yl)-4-(morpholin-4-ylmethyl)pyridine-2,6-diamine is sourced from PubChem (CID 146425111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).