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

C19H17N5 — CID 118577026

IUPAC3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine
SMILESCc1nc(-n2ccc3ccncc32)ccc1-c1ccnc(N)c1C
InChIInChI=1S/C19H17N5/c1-12-15(6-9-22-19(12)20)16-3-4-18(23-13(16)2)24-10-7-14-5-8-21-11-17(14)24/h3-11H,1-2H3,(H2,20,22)
InChIKeyXIXGNDPTLSOWMQ-UHFFFAOYSA-N
MW315.38 g/mol
LogP3.68
Rot. Bonds2

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

3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine (PubChem CID 118577026) has the molecular formula C19H17N5 and a molecular weight of 315.38 g/mol. Its IUPAC name is 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine
PubChem CID118577026
Molecular FormulaC19H17N5
Molecular Weight315.38 g/mol
Exact Mass315.15
IUPAC Name3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine
SMILESCc1nc(-n2ccc3ccncc32)ccc1-c1ccnc(N)c1C
InChIInChI=1S/C19H17N5/c1-12-15(6-9-22-19(12)20)16-3-4-18(23-13(16)2)24-10-7-14-5-8-21-11-17(14)24/h3-11H,1-2H3,(H2,20,22)
InChIKeyXIXGNDPTLSOWMQ-UHFFFAOYSA-N
XLogP3.68
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine?
The IUPAC name of 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine (CID 118577026) is 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine.
What is the SMILES notation for 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine?
The canonical SMILES for 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine is Cc1nc(-n2ccc3ccncc32)ccc1-c1ccnc(N)c1C.
What is the InChIKey of 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine?
The InChIKey is XIXGNDPTLSOWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5/c1-12-15(6-9-22-19(12)20)16-3-4-18(23-13(16)2)24-10-7-14-5-8-21-11-17(14)24/h3-11H,1-2H3,(H2,20,22).
What are the key properties of 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine?
3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine has a molecular weight of 315.38 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(2-methyl-6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 118577026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).