4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine

C19H19N5O — CID 56895128

IUPAC4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine
SMILESc1cc2occc2c(-c2cc(NC3CCNCC3)nc3[nH]ccc23)n1
InChIInChI=1S/C19H19N5O/c1-6-20-7-2-12(1)23-17-11-15(13-3-8-22-19(13)24-17)18-14-5-10-25-16(14)4-9-21-18/h3-5,8-12,20H,1-2,6-7H2,(H2,22,23,24)
InChIKeyDTRHTGDFUUQFSB-UHFFFAOYSA-N
MW333.40 g/mol
LogP3.54
Rot. Bonds3

About 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine

4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine (PubChem CID 56895128) has the molecular formula C19H19N5O and a molecular weight of 333.40 g/mol. Its IUPAC name is 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine.

Molecular Properties

Compound Name4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine
PubChem CID56895128
Molecular FormulaC19H19N5O
Molecular Weight333.40 g/mol
Exact Mass333.16
IUPAC Name4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine
SMILESc1cc2occc2c(-c2cc(NC3CCNCC3)nc3[nH]ccc23)n1
InChIInChI=1S/C19H19N5O/c1-6-20-7-2-12(1)23-17-11-15(13-3-8-22-19(13)24-17)18-14-5-10-25-16(14)4-9-21-18/h3-5,8-12,20H,1-2,6-7H2,(H2,22,23,24)
InChIKeyDTRHTGDFUUQFSB-UHFFFAOYSA-N
XLogP3.54
TPSA78.77 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.40
LogP ≤ 53.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine?
The IUPAC name of 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine (CID 56895128) is 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine.
What is the SMILES notation for 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine?
The canonical SMILES for 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine is c1cc2occc2c(-c2cc(NC3CCNCC3)nc3[nH]ccc23)n1.
What is the InChIKey of 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine?
The InChIKey is DTRHTGDFUUQFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O/c1-6-20-7-2-12(1)23-17-11-15(13-3-8-22-19(13)24-17)18-14-5-10-25-16(14)4-9-21-18/h3-5,8-12,20H,1-2,6-7H2,(H2,22,23,24).
What are the key properties of 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine?
4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine has a molecular weight of 333.40 g/mol, XLogP of 3.54, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-furo[3,2-c]pyridin-4-yl-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine is sourced from PubChem (CID 56895128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).