N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide

C26H31N5O2 — CID 67353594

IUPACN-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide
SMILESCC(=O)NC1CCC(Nc2nc(-c3ccc(N4CCOCC4)cc3)cc3ncccc23)CC1
InChIInChI=1S/C26H31N5O2/c1-18(32)28-20-6-8-21(9-7-20)29-26-23-3-2-12-27-25(23)17-24(30-26)19-4-10-22(11-5-19)31-13-15-33-16-14-31/h2-5,10-12,17,20-21H,6-9,13-16H2,1H3,(H,28,32)(H,29,30)
InChIKeyHPQYOFLHLHFXPB-UHFFFAOYSA-N
MW445.57 g/mol
LogP3.99
Rot. Bonds5

About N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide

N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide (PubChem CID 67353594) has the molecular formula C26H31N5O2 and a molecular weight of 445.57 g/mol. Its IUPAC name is N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide
PubChem CID67353594
Molecular FormulaC26H31N5O2
Molecular Weight445.57 g/mol
Exact Mass445.25
IUPAC NameN-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide
SMILESCC(=O)NC1CCC(Nc2nc(-c3ccc(N4CCOCC4)cc3)cc3ncccc23)CC1
InChIInChI=1S/C26H31N5O2/c1-18(32)28-20-6-8-21(9-7-20)29-26-23-3-2-12-27-25(23)17-24(30-26)19-4-10-22(11-5-19)31-13-15-33-16-14-31/h2-5,10-12,17,20-21H,6-9,13-16H2,1H3,(H,28,32)(H,29,30)
InChIKeyHPQYOFLHLHFXPB-UHFFFAOYSA-N
XLogP3.99
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.57
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide
CID 91234911
2-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]pyridine-3-carboxamide
CID 58398133
4-[4-(5-chloro-1,6-naphthyridin-7-yl)phenyl]morpholine;ethane
CID 143936489
2-aminopyridine-3-carboxamide;4-[4-(5-chloro-1,6-naphthyridin-7-yl)phenyl]morpholine;2-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]pyridine-3-carboxamide
CID 160644132
1-[(2R)-2-[[[7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-yl]amino]methyl]morpholin-4-yl]ethanone
CID 71113527
4-[4-(1,6-naphthyridin-7-yl)phenyl]morpholine
CID 91552475
5-[5-[(4-aminocyclohexyl)amino]-1,6-naphthyridin-7-yl]-2-(methylamino)phenol
CID 142261651
N-methyl-N-[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]morpholin-2-amine
CID 67187234
(3S)-1-[7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-yl]pyrrolidine-3-carboxylic acid
CID 71113836
tert-butyl 3-[[[7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-yl]amino]methyl]piperidine-1-carboxylate
CID 71113692
1-[2-[[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]amino]pyrimidin-4-yl]oxypropan-2-one
CID 175633431
2-fluoro-2-methyl-1-[(2R)-2-[[[7-(4-morpholin-4-ylphenyl)pyrido[3,4-b]pyrazin-5-yl]amino]methyl]morpholin-4-yl]propan-1-one
CID 71113795

Frequently Asked Questions

What is the IUPAC name of N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide?
The IUPAC name of N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide (CID 67353594) is N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide.
What is the SMILES notation for N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide?
The canonical SMILES for N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide is CC(=O)NC1CCC(Nc2nc(-c3ccc(N4CCOCC4)cc3)cc3ncccc23)CC1.
What is the InChIKey of N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide?
The InChIKey is HPQYOFLHLHFXPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H31N5O2/c1-18(32)28-20-6-8-21(9-7-20)29-26-23-3-2-12-27-25(23)17-24(30-26)19-4-10-22(11-5-19)31-13-15-33-16-14-31/h2-5,10-12,17,20-21H,6-9,13-16H2,1H3,(H,28,32)(H,29,30).
What are the key properties of N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide?
N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide has a molecular weight of 445.57 g/mol, XLogP of 3.99, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[7-(4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]amino]cyclohexyl]acetamide is sourced from PubChem (CID 67353594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).