N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine

C19H13ClN6O — CID 53320631

IUPACN-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine
SMILESCc1cc(Nc2c(-c3ncccn3)oc3cnccc23)c2cn[nH]c2c1Cl
InChIInChI=1S/C19H13ClN6O/c1-10-7-13(12-8-24-26-16(12)15(10)20)25-17-11-3-6-21-9-14(11)27-18(17)19-22-4-2-5-23-19/h2-9,25H,1H3,(H,24,26)
InChIKeyZOOUXHZNCBQCRB-UHFFFAOYSA-N
MW376.81 g/mol
LogP4.87
Rot. Bonds3

About N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine

N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine (PubChem CID 53320631) has the molecular formula C19H13ClN6O and a molecular weight of 376.81 g/mol. Its IUPAC name is N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine.

Molecular Properties

Compound NameN-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine
PubChem CID53320631
Molecular FormulaC19H13ClN6O
Molecular Weight376.81 g/mol
Exact Mass376.08
IUPAC NameN-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine
SMILESCc1cc(Nc2c(-c3ncccn3)oc3cnccc23)c2cn[nH]c2c1Cl
InChIInChI=1S/C19H13ClN6O/c1-10-7-13(12-8-24-26-16(12)15(10)20)25-17-11-3-6-21-9-14(11)27-18(17)19-22-4-2-5-23-19/h2-9,25H,1H3,(H,24,26)
InChIKeyZOOUXHZNCBQCRB-UHFFFAOYSA-N
XLogP4.87
TPSA92.52 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.81
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine?
The IUPAC name of N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine (CID 53320631) is N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine.
What is the SMILES notation for N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine?
The canonical SMILES for N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine is Cc1cc(Nc2c(-c3ncccn3)oc3cnccc23)c2cn[nH]c2c1Cl.
What is the InChIKey of N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine?
The InChIKey is ZOOUXHZNCBQCRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClN6O/c1-10-7-13(12-8-24-26-16(12)15(10)20)25-17-11-3-6-21-9-14(11)27-18(17)19-22-4-2-5-23-19/h2-9,25H,1H3,(H,24,26).
What are the key properties of N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine?
N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine has a molecular weight of 376.81 g/mol, XLogP of 4.87, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-chloro-6-methyl-1H-indazol-4-yl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine is sourced from PubChem (CID 53320631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).