1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine

C22H25N5 — CID 155123958

IUPAC1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine
SMILESCc1c(-c2ccnc3c2c(N)cn3C)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C22H25N5/c1-13-17-11-15(14-5-8-24-9-6-14)3-4-19(17)26-21(13)16-7-10-25-22-20(16)18(23)12-27(22)2/h3-4,7,10-12,14,24,26H,5-6,8-9,23H2,1-2H3
InChIKeyHZCNLMKPJVUZRG-UHFFFAOYSA-N
MW359.48 g/mol
LogP4.08
Rot. Bonds2

About 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine

1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine (PubChem CID 155123958) has the molecular formula C22H25N5 and a molecular weight of 359.48 g/mol. Its IUPAC name is 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine.

Molecular Properties

Compound Name1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine
PubChem CID155123958
Molecular FormulaC22H25N5
Molecular Weight359.48 g/mol
Exact Mass359.21
IUPAC Name1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine
SMILESCc1c(-c2ccnc3c2c(N)cn3C)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C22H25N5/c1-13-17-11-15(14-5-8-24-9-6-14)3-4-19(17)26-21(13)16-7-10-25-22-20(16)18(23)12-27(22)2/h3-4,7,10-12,14,24,26H,5-6,8-9,23H2,1-2H3
InChIKeyHZCNLMKPJVUZRG-UHFFFAOYSA-N
XLogP4.08
TPSA71.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.48
LogP ≤ 54.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine with MolForge

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Related Compounds

2-methyl-7-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)-1H-imidazo[4,5-b]pyridine
CID 142594625
3-methyl-7-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[4,5-b]pyridine
CID 142593803
1-methyl-4-[3-methyl-5-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]-1H-indol-2-yl]pyrrolo[2,3-b]pyridine
CID 142594229
2,3-dimethyl-5-piperidin-4-yl-1H-indole
CID 82391168
2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol
CID 134329906
2-(3-fluoro-2-methyl-4-pyridinyl)-5-piperidin-4-yl-3-propan-2-yl-1H-indole
CID 134329624
3-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine
CID 142593745
3-cyclopropyl-2-(2,6-dimethyl-4-pyridinyl)-5-piperidin-4-yl-1H-indole
CID 134329293
4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridin-3-ol
CID 142594614
2-methyl-5-piperidin-4-ylaniline
CID 105444511
7-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-imidazo[4,5-b]pyridine
CID 142594142
ethane;7-piperidin-4-ylisoquinolin-1-amine
CID 91457940

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine?
The IUPAC name of 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine (CID 155123958) is 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine.
What is the SMILES notation for 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine?
The canonical SMILES for 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine is Cc1c(-c2ccnc3c2c(N)cn3C)[nH]c2ccc(C3CCNCC3)cc12.
What is the InChIKey of 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine?
The InChIKey is HZCNLMKPJVUZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5/c1-13-17-11-15(14-5-8-24-9-6-14)3-4-19(17)26-21(13)16-7-10-25-22-20(16)18(23)12-27(22)2/h3-4,7,10-12,14,24,26H,5-6,8-9,23H2,1-2H3.
What are the key properties of 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine?
1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine has a molecular weight of 359.48 g/mol, XLogP of 4.08, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(3-methyl-5-piperidin-4-yl-1H-indol-2-yl)pyrrolo[2,3-b]pyridin-3-amine is sourced from PubChem (CID 155123958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).