2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine

C21H26N6O2S — CID 57442110

IUPAC2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine
SMILESCC1CN(c2nc(N3CCOCC3)c3ccc(Nc4ccsc4)nc3n2)CC(C)O1
InChIInChI=1S/C21H26N6O2S/c1-14-11-27(12-15(2)29-14)21-24-19-17(20(25-21)26-6-8-28-9-7-26)3-4-18(23-19)22-16-5-10-30-13-16/h3-5,10,13-15H,6-9,11-12H2,1-2H3,(H,22,23,24,25)
InChIKeyRFMVUBSGXWIVKE-UHFFFAOYSA-N
MW426.55 g/mol
LogP3.28
Rot. Bonds4

About 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine

2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine (PubChem CID 57442110) has the molecular formula C21H26N6O2S and a molecular weight of 426.55 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine
PubChem CID57442110
Molecular FormulaC21H26N6O2S
Molecular Weight426.55 g/mol
Exact Mass426.18
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine
SMILESCC1CN(c2nc(N3CCOCC3)c3ccc(Nc4ccsc4)nc3n2)CC(C)O1
InChIInChI=1S/C21H26N6O2S/c1-14-11-27(12-15(2)29-14)21-24-19-17(20(25-21)26-6-8-28-9-7-26)3-4-18(23-19)22-16-5-10-30-13-16/h3-5,10,13-15H,6-9,11-12H2,1-2H3,(H,22,23,24,25)
InChIKeyRFMVUBSGXWIVKE-UHFFFAOYSA-N
XLogP3.28
TPSA75.64 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.55
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine with MolForge

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Related Compounds

2-[[2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]amino]quinolin-8-ol
CID 57442114
N-[2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]-2-methylsulfanyl-1,3-benzothiazol-6-amine
CID 68942327
4-[[2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]amino]-1H-imidazole-5-carbonitrile
CID 68944120
N-[2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]quinoxaline-2-carboxamide
CID 57442128
2,6-dimethyl-4-[7-(3-methylphenyl)-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-2-yl]morpholine
CID 57442061
4-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]-2,6-dimethoxyphenol
CID 135611079
[3-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol
CID 16736154
N-[[5-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl]methyl]-2-methoxyethanamine
CID 59776884
N-[[5-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl]methyl]-4-phenylmethoxyaniline
CID 16738111
N-[[5-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl]methyl]-2-(4-methoxyphenyl)ethanamine
CID 16735754
2-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylpyrimidin-5-yl]-2-methylpropanoic acid
CID 72853871
4-[4-(4-methylpiperidin-1-yl)quinazolin-2-yl]morpholine;hydrochloride
CID 6459337

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine (CID 57442110) is 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine is CC1CN(c2nc(N3CCOCC3)c3ccc(Nc4ccsc4)nc3n2)CC(C)O1.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine?
The InChIKey is RFMVUBSGXWIVKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N6O2S/c1-14-11-27(12-15(2)29-14)21-24-19-17(20(25-21)26-6-8-28-9-7-26)3-4-18(23-19)22-16-5-10-30-13-16/h3-5,10,13-15H,6-9,11-12H2,1-2H3,(H,22,23,24,25).
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine?
2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine has a molecular weight of 426.55 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)-4-morpholin-4-yl-N-thiophen-3-ylpyrido[2,3-d]pyrimidin-7-amine is sourced from PubChem (CID 57442110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).