N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine

C54H60N6O6 — CID 155810703

IUPACN-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine
SMILESCOc1cc2c(OC)c(-c3c(C)cc4c(-c5nc6ccccn6c5NC5CCCCC5)c(OC)c(OC)cc4c3OC)c(C)cc2c(-c2nc3ccccn3c2NC2CCCCC2)c1OC
InChIInChI=1S/C54H60N6O6/c1-31-27-35-37(29-39(61-3)51(65-7)45(35)47-53(55-33-19-11-9-12-20-33)59-25-17-15-23-41(59)57-47)49(63-5)43(31)44-32(2)28-36-38(50(44)64-6)30-40(62-4)52(66-8)46(36)48-54(56-34-21-13-10-14-22-34)60-26-18-16-24-42(60)58-48/h15-18,23-30,33-34,55-56H,9-14,19-22H2,1-8H3
InChIKeyYZJYWODWDFYXEU-UHFFFAOYSA-N
MW889.11 g/mol
LogP12.45
Rot. Bonds13

About N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine

N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine (PubChem CID 155810703) has the molecular formula C54H60N6O6 and a molecular weight of 889.11 g/mol. Its IUPAC name is N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine
PubChem CID155810703
Molecular FormulaC54H60N6O6
Molecular Weight889.11 g/mol
Exact Mass888.46
IUPAC NameN-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine
SMILESCOc1cc2c(OC)c(-c3c(C)cc4c(-c5nc6ccccn6c5NC5CCCCC5)c(OC)c(OC)cc4c3OC)c(C)cc2c(-c2nc3ccccn3c2NC2CCCCC2)c1OC
InChIInChI=1S/C54H60N6O6/c1-31-27-35-37(29-39(61-3)51(65-7)45(35)47-53(55-33-19-11-9-12-20-33)59-25-17-15-23-41(59)57-47)49(63-5)43(31)44-32(2)28-36-38(50(44)64-6)30-40(62-4)52(66-8)46(36)48-54(56-34-21-13-10-14-22-34)60-26-18-16-24-42(60)58-48/h15-18,23-30,33-34,55-56H,9-14,19-22H2,1-8H3
InChIKeyYZJYWODWDFYXEU-UHFFFAOYSA-N
XLogP12.45
TPSA114.04 Ų
H-Bond Donors2
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms66
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500889.11
LogP ≤ 512.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1012

Analyze N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine (CID 155810703) is N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine is COc1cc2c(OC)c(-c3c(C)cc4c(-c5nc6ccccn6c5NC5CCCCC5)c(OC)c(OC)cc4c3OC)c(C)cc2c(-c2nc3ccccn3c2NC2CCCCC2)c1OC.
What is the InChIKey of N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine?
The InChIKey is YZJYWODWDFYXEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H60N6O6/c1-31-27-35-37(29-39(61-3)51(65-7)45(35)47-53(55-33-19-11-9-12-20-33)59-25-17-15-23-41(59)57-47)49(63-5)43(31)44-32(2)28-36-38(50(44)64-6)30-40(62-4)52(66-8)46(36)48-54(56-34-21-13-10-14-22-34)60-26-18-16-24-42(60)58-48/h15-18,23-30,33-34,55-56H,9-14,19-22H2,1-8H3.
What are the key properties of N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine?
N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine has a molecular weight of 889.11 g/mol, XLogP of 12.45, 13 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 155810703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).