4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine

C25H32N6 — CID 46900230

IUPAC4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine
SMILESNCC1CCN(c2nc(-c3ccnc(NC4CCCCC4)c3)cc3cnccc23)CC1
InChIInChI=1S/C25H32N6/c26-16-18-8-12-31(13-9-18)25-22-7-10-27-17-20(22)14-23(30-25)19-6-11-28-24(15-19)29-21-4-2-1-3-5-21/h6-7,10-11,14-15,17-18,21H,1-5,8-9,12-13,16,26H2,(H,28,29)
InChIKeyQWNXSMLOHRKBQW-UHFFFAOYSA-N
MW416.57 g/mol
LogP4.61
Rot. Bonds5

About 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine

4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine (PubChem CID 46900230) has the molecular formula C25H32N6 and a molecular weight of 416.57 g/mol. Its IUPAC name is 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine.

Molecular Properties

Compound Name4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine
PubChem CID46900230
Molecular FormulaC25H32N6
Molecular Weight416.57 g/mol
Exact Mass416.27
IUPAC Name4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine
SMILESNCC1CCN(c2nc(-c3ccnc(NC4CCCCC4)c3)cc3cnccc23)CC1
InChIInChI=1S/C25H32N6/c26-16-18-8-12-31(13-9-18)25-22-7-10-27-17-20(22)14-23(30-25)19-6-11-28-24(15-19)29-21-4-2-1-3-5-21/h6-7,10-11,14-15,17-18,21H,1-5,8-9,12-13,16,26H2,(H,28,29)
InChIKeyQWNXSMLOHRKBQW-UHFFFAOYSA-N
XLogP4.61
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.57
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine with MolForge

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Related Compounds

Isoquinoline, 1-amino-3-(2-pyridyl)-
CID 217000
Sri-9439
CID 446752
Cyclohexyl-(4-(1-piperazin-1-yl(2,6)naphthyridin-3-yl)pyridin-2-yl)amine
CID 25020250
N-{6-[3-(Piperazin-1-Yl)phenyl]pyridin-2-Yl}-4-(Trifluoromethyl)pyridin-2-Amine
CID 56947354
N-[(5-methylpyrimidin-2-yl)methyl]-6-phenyl-2-(pyridin-3-yl)pyrimidin-4-amine
CID 3296768
4-N-benzylpyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328077
N-{7-[4-(Dimethylamino)phenyl]-1,6-Naphthyridin-5-Yl}propane-1,3-Diamine
CID 9818573
1-Phenyl-3-(3-(pyridin-2-yl)isoquinolin-1-yl)urea
CID 10640891
1-(Piperazin-1-yl)isoquinoline
CID 15887436
2-Methyl-N~1~-[3-(Pyridin-4-Yl)-2,6-Naphthyridin-1-Yl]propane-1,2-Diamine
CID 24996161
6,6'-(Pyridine-3,5-Diyldiethane-2,1-Diyl)bis(4-Methylpyridin-2-Amine)
CID 46847260
6-(2-{5-[2-(2-Amino-6-Methylpyridin-4-Yl)ethyl]pyridin-3-Yl}ethyl)-4-Methylpyridin-2-Amine
CID 46892823

Frequently Asked Questions

What is the IUPAC name of 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine?
The IUPAC name of 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine (CID 46900230) is 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine.
What is the SMILES notation for 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine?
The canonical SMILES for 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine is NCC1CCN(c2nc(-c3ccnc(NC4CCCCC4)c3)cc3cnccc23)CC1.
What is the InChIKey of 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine?
The InChIKey is QWNXSMLOHRKBQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N6/c26-16-18-8-12-31(13-9-18)25-22-7-10-27-17-20(22)14-23(30-25)19-6-11-28-24(15-19)29-21-4-2-1-3-5-21/h6-7,10-11,14-15,17-18,21H,1-5,8-9,12-13,16,26H2,(H,28,29).
What are the key properties of 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine?
4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine has a molecular weight of 416.57 g/mol, XLogP of 4.61, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[4-(aminomethyl)piperidin-1-yl]-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine is sourced from PubChem (CID 46900230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).