N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine

C15H22N4 — CID 15195687

IUPACN,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine
SMILESCCN(CC)c1ccc2c(n1)=NC1(CCCCC1)N=2
InChIInChI=1S/C15H22N4/c1-3-19(4-2)13-9-8-12-14(16-13)18-15(17-12)10-6-5-7-11-15/h8-9H,3-7,10-11H2,1-2H3
InChIKeyAPHXHNRYHNZJFY-UHFFFAOYSA-N
MW258.37 g/mol
LogP1.84
Rot. Bonds3

About N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine

N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine (PubChem CID 15195687) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine.

Molecular Properties

Compound NameN,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine
PubChem CID15195687
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC NameN,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine
SMILESCCN(CC)c1ccc2c(n1)=NC1(CCCCC1)N=2
InChIInChI=1S/C15H22N4/c1-3-19(4-2)13-9-8-12-14(16-13)18-15(17-12)10-6-5-7-11-15/h8-9H,3-7,10-11H2,1-2H3
InChIKeyAPHXHNRYHNZJFY-UHFFFAOYSA-N
XLogP1.84
TPSA40.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclohexyl-N-propan-2-yl-2,5-dihydropyridin-6-imine
CID 56607994
N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-c]pyridine]-4'-amine
CID 15195700

Frequently Asked Questions

What is the IUPAC name of N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine?
The IUPAC name of N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine (CID 15195687) is N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine.
What is the SMILES notation for N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine?
The canonical SMILES for N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine is CCN(CC)c1ccc2c(n1)=NC1(CCCCC1)N=2.
What is the InChIKey of N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine?
The InChIKey is APHXHNRYHNZJFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-3-19(4-2)13-9-8-12-14(16-13)18-15(17-12)10-6-5-7-11-15/h8-9H,3-7,10-11H2,1-2H3.
What are the key properties of N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine?
N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine has a molecular weight of 258.37 g/mol, XLogP of 1.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylspiro[cyclohexane-1,2'-imidazo[4,5-b]pyridine]-5'-amine is sourced from PubChem (CID 15195687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).