N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine

C14H20N4O — CID 103385751

IUPACN-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine
SMILESCn1cnc2c(NC3CCOC(C)(C)C3)nccc21
InChIInChI=1S/C14H20N4O/c1-14(2)8-10(5-7-19-14)17-13-12-11(4-6-15-13)18(3)9-16-12/h4,6,9-10H,5,7-8H2,1-3H3,(H,15,17)
InChIKeyZGLOKBPQAMXTCD-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.34
Rot. Bonds2

About N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine

N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine (PubChem CID 103385751) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine
PubChem CID103385751
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine
SMILESCn1cnc2c(NC3CCOC(C)(C)C3)nccc21
InChIInChI=1S/C14H20N4O/c1-14(2)8-10(5-7-19-14)17-13-12-11(4-6-15-13)18(3)9-16-12/h4,6,9-10H,5,7-8H2,1-3H3,(H,15,17)
InChIKeyZGLOKBPQAMXTCD-UHFFFAOYSA-N
XLogP2.34
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine (CID 103385751) is N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine is Cn1cnc2c(NC3CCOC(C)(C)C3)nccc21.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine?
The InChIKey is ZGLOKBPQAMXTCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-14(2)8-10(5-7-19-14)17-13-12-11(4-6-15-13)18(3)9-16-12/h4,6,9-10H,5,7-8H2,1-3H3,(H,15,17).
What are the key properties of N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine?
N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine has a molecular weight of 260.34 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)-1-methylimidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 103385751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).