N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine

C23H28N6 — CID 46900888

IUPACN-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine
SMILESc1cnc2cc(-c3ccnc(NC4CCCCC4)c3)nc(N3CCNCC3)c2c1
InChIInChI=1S/C23H28N6/c1-2-5-18(6-3-1)27-22-15-17(8-10-26-22)20-16-21-19(7-4-9-25-21)23(28-20)29-13-11-24-12-14-29/h4,7-10,15-16,18,24H,1-3,5-6,11-14H2,(H,26,27)
InChIKeyBGIJGABXTZLUDF-UHFFFAOYSA-N
MW388.52 g/mol
LogP3.85
Rot. Bonds4

About N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine

N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine (PubChem CID 46900888) has the molecular formula C23H28N6 and a molecular weight of 388.52 g/mol. Its IUPAC name is N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine
PubChem CID46900888
Molecular FormulaC23H28N6
Molecular Weight388.52 g/mol
Exact Mass388.24
IUPAC NameN-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine
SMILESc1cnc2cc(-c3ccnc(NC4CCCCC4)c3)nc(N3CCNCC3)c2c1
InChIInChI=1S/C23H28N6/c1-2-5-18(6-3-1)27-22-15-17(8-10-26-22)20-16-21-19(7-4-9-25-21)23(28-20)29-13-11-24-12-14-29/h4,7-10,15-16,18,24H,1-3,5-6,11-14H2,(H,26,27)
InChIKeyBGIJGABXTZLUDF-UHFFFAOYSA-N
XLogP3.85
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.52
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine?
The IUPAC name of N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine (CID 46900888) is N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine.
What is the SMILES notation for N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine?
The canonical SMILES for N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine is c1cnc2cc(-c3ccnc(NC4CCCCC4)c3)nc(N3CCNCC3)c2c1.
What is the InChIKey of N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine?
The InChIKey is BGIJGABXTZLUDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N6/c1-2-5-18(6-3-1)27-22-15-17(8-10-26-22)20-16-21-19(7-4-9-25-21)23(28-20)29-13-11-24-12-14-29/h4,7-10,15-16,18,24H,1-3,5-6,11-14H2,(H,26,27).
What are the key properties of N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine?
N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine has a molecular weight of 388.52 g/mol, XLogP of 3.85, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(5-piperazin-1-yl-1,6-naphthyridin-7-yl)pyridin-2-amine is sourced from PubChem (CID 46900888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).