2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine

C16H16N4O — CID 169097942

IUPAC2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine
SMILESCc1cc(-c2cc3cnc(NC4COC4)cc3[nH]2)ccn1
InChIInChI=1S/C16H16N4O/c1-10-4-11(2-3-17-10)14-5-12-7-18-16(6-15(12)20-14)19-13-8-21-9-13/h2-7,13,20H,8-9H2,1H3,(H,18,19)
InChIKeyVFWJITQLJAESPQ-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.74
Rot. Bonds3

About 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine

2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine (PubChem CID 169097942) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine.

Molecular Properties

Compound Name2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine
PubChem CID169097942
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine
SMILESCc1cc(-c2cc3cnc(NC4COC4)cc3[nH]2)ccn1
InChIInChI=1S/C16H16N4O/c1-10-4-11(2-3-17-10)14-5-12-7-18-16(6-15(12)20-14)19-13-8-21-9-13/h2-7,13,20H,8-9H2,1H3,(H,18,19)
InChIKeyVFWJITQLJAESPQ-UHFFFAOYSA-N
XLogP2.74
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine with MolForge

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Related Compounds

2-(2-methyl-4-pyridinyl)-N-[(3S)-oxan-3-yl]-1H-pyrrolo[3,2-c]pyridin-6-amine
CID 164564863
2-(2-methyl-4-pyridinyl)-N-[(3R)-oxan-3-yl]-1H-pyrrolo[3,2-c]pyridin-6-amine
CID 164564817
N-[2-(2-methyl-4-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]oxane-3-carboxamide
CID 164564847
N-[2-(2-methyl-4-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]bicyclo[3.1.0]hexane-6-carboxamide
CID 169097630
1-methyl-2-(2-methyl-4-pyridinyl)-N-(oxan-4-yl)pyrrolo[3,2-c]pyridin-6-amine
CID 164564724
5-(2,6-dimethyl-4-pyridinyl)-2-(2-methyl-4-pyridinyl)-1H-indole
CID 146452003
2-chloro-N-(oxetan-3-yl)pyrimidin-4-amine
CID 140802487
N-phenyl-2-pyridin-3-yl-1H-pyrrolo[3,2-c]pyridin-6-amine
CID 169097748
2-methyl-N-(oxetan-3-yl)pyridine-4-carboxamide
CID 106753340
5-(2-methyl-4-pyridinyl)-1H-indazole
CID 143158050
4-(3H-isoindol-1-yl)-N-(oxetan-3-yl)pyridin-2-amine
CID 147824254
2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
CID 90245533

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine?
The IUPAC name of 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine (CID 169097942) is 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine.
What is the SMILES notation for 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine?
The canonical SMILES for 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine is Cc1cc(-c2cc3cnc(NC4COC4)cc3[nH]2)ccn1.
What is the InChIKey of 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine?
The InChIKey is VFWJITQLJAESPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-10-4-11(2-3-17-10)14-5-12-7-18-16(6-15(12)20-14)19-13-8-21-9-13/h2-7,13,20H,8-9H2,1H3,(H,18,19).
What are the key properties of 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine?
2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine has a molecular weight of 280.33 g/mol, XLogP of 2.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-4-pyridinyl)-N-(oxetan-3-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine is sourced from PubChem (CID 169097942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).