6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine

C12H19N3O2 — CID 114240788

IUPAC6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine
SMILESCOc1nc(NC2CCOCC2C)ccc1N
InChIInChI=1S/C12H19N3O2/c1-8-7-17-6-5-10(8)14-11-4-3-9(13)12(15-11)16-2/h3-4,8,10H,5-7,13H2,1-2H3,(H,14,15)
InChIKeyXSMHGEZYODMWQG-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.51
Rot. Bonds3

About 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine

6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine (PubChem CID 114240788) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine
PubChem CID114240788
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine
SMILESCOc1nc(NC2CCOCC2C)ccc1N
InChIInChI=1S/C12H19N3O2/c1-8-7-17-6-5-10(8)14-11-4-3-9(13)12(15-11)16-2/h3-4,8,10H,5-7,13H2,1-2H3,(H,14,15)
InChIKeyXSMHGEZYODMWQG-UHFFFAOYSA-N
XLogP1.51
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-2-N-(oxan-3-yl)pyridine-2,5-diamine
CID 63359888
6-methoxy-2-N-(oxolan-3-ylmethyl)pyridine-2,5-diamine
CID 62824708
6-N,2-dimethyl-4-N-(3-methyloxan-4-yl)pyrimidine-4,6-diamine
CID 114241669
2-N-(2,4-dimethylcyclohexyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 63995454
6-methoxy-2-N-(oxolan-2-ylmethyl)pyridine-2,5-diamine
CID 43261205
2-N-(2,3-dimethylcyclohexyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 43261108
2-N-(oxan-3-yl)-6-propan-2-yloxypyridine-2,5-diamine
CID 63359972
2-N-(2,6-dimethylpiperidin-1-yl)-6-methoxypyridine-2,5-diamine
CID 83003352
N-(3-methyloxan-4-yl)-1,2,4-benzotriazin-3-amine
CID 114241071
4-amino-3-hydroxy-N-(3-methyloxan-4-yl)benzamide
CID 114240743
2-N-(3-methylcyclopentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 114543221
6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine
CID 79827207

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine?
The IUPAC name of 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine (CID 114240788) is 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine.
What is the SMILES notation for 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine?
The canonical SMILES for 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine is COc1nc(NC2CCOCC2C)ccc1N.
What is the InChIKey of 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine?
The InChIKey is XSMHGEZYODMWQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-8-7-17-6-5-10(8)14-11-4-3-9(13)12(15-11)16-2/h3-4,8,10H,5-7,13H2,1-2H3,(H,14,15).
What are the key properties of 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine?
6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine has a molecular weight of 237.30 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(3-methyloxan-4-yl)pyridine-2,5-diamine is sourced from PubChem (CID 114240788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).