(2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine

C22H26N6O2 — CID 46882230

IUPAC(2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine
SMILESC[C@@H]1CN(c2nc(N3CCOCC3)c3ccc(-c4ccncc4)nc3n2)C[C@H](C)O1
InChIInChI=1S/C22H26N6O2/c1-15-13-28(14-16(2)30-15)22-25-20-18(21(26-22)27-9-11-29-12-10-27)3-4-19(24-20)17-5-7-23-8-6-17/h3-8,15-16H,9-14H2,1-2H3/t15-,16+
InChIKeyAJZWAGWWZCXPPF-IYBDPMFKSA-N
MW406.49 g/mol
LogP2.54
Rot. Bonds3

About (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine

(2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine (PubChem CID 46882230) has the molecular formula C22H26N6O2 and a molecular weight of 406.49 g/mol. Its IUPAC name is (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine.

Molecular Properties

Compound Name(2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine
PubChem CID46882230
Molecular FormulaC22H26N6O2
Molecular Weight406.49 g/mol
Exact Mass406.21
IUPAC Name(2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine
SMILESC[C@@H]1CN(c2nc(N3CCOCC3)c3ccc(-c4ccncc4)nc3n2)C[C@H](C)O1
InChIInChI=1S/C22H26N6O2/c1-15-13-28(14-16(2)30-15)22-25-20-18(21(26-22)27-9-11-29-12-10-27)3-4-19(24-20)17-5-7-23-8-6-17/h3-8,15-16H,9-14H2,1-2H3/t15-,16+
InChIKeyAJZWAGWWZCXPPF-IYBDPMFKSA-N
XLogP2.54
TPSA76.50 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.49
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine with MolForge

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Launch Full Analysis

Related Compounds

Abt-702
CID 1973
5-(4-(Dimethylamino)phenyl)-6-(6-morpholin-4-ylpyridin-3-ylethynyl)pyrimidin-4-ylamine
CID 11987868
Pyrazolo pyrimidine, 5k
CID 25196900
2-(1-{[2-(2-Aminopyrimidin-5-Yl)-4-(Morpholin-4-Yl)pyrido[3,2-D]pyrimidin-6-Yl]methyl}piperidin-4-Yl)propan-2-Ol
CID 53378053
5-(2-Bromo-benzyl)-7-(6-morpholin-4-yl-pyridin-3-yl)-pyrido[2,3-d]pyrimidin-4-ylamine
CID 10005239
5-[1-(2-Bromo-phenyl)-ethyl]-7-(6-morpholin-4-yl-pyridin-3-yl)-pyrido[2,3-d]pyrimidin-4-ylamine
CID 10435708
2-(((2S,6R)-2,6-dimethylmorpholino)methyl)-7-(3-(trifluoromethyl)pyridin-2-yl)-N-(5-(trifluoromethyl)pyridin-2-yl)quinazolin-4-amine
CID 44587857
Pyrido[4,3-d]pyrimidine deriv. 4r
CID 5328328
4-N-(3-methylphenyl)-6-N-[2-(morpholin-4-yl)ethyl]pyrido[3,4-d]pyrimidine-4,6-diamine
CID 5328378
4-N-(3-methylphenyl)-6-N-[3-(morpholin-4-yl)propyl]pyrido[3,4-d]pyrimidine-4,6-diamine
CID 5328379
6-{2-[6-(Morpholin-4-yl)pyridin-3-yl]ethynyl}-5-(3-phenylpropyl)pyrimidin-4-amine
CID 10883874
5-Benzyl-6-{2-[6-(morpholin-4-yl)pyridin-3-yl]ethynyl}pyrimidin-4-amine
CID 10959648

Frequently Asked Questions

What is the IUPAC name of (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine?
The IUPAC name of (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine (CID 46882230) is (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine.
What is the SMILES notation for (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine?
The canonical SMILES for (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine is C[C@@H]1CN(c2nc(N3CCOCC3)c3ccc(-c4ccncc4)nc3n2)C[C@H](C)O1.
What is the InChIKey of (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine?
The InChIKey is AJZWAGWWZCXPPF-IYBDPMFKSA-N. The full InChI is InChI=1S/C22H26N6O2/c1-15-13-28(14-16(2)30-15)22-25-20-18(21(26-22)27-9-11-29-12-10-27)3-4-19(24-20)17-5-7-23-8-6-17/h3-8,15-16H,9-14H2,1-2H3/t15-,16+.
What are the key properties of (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine?
(2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine has a molecular weight of 406.49 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-2,6-dimethyl-4-(4-morpholin-4-yl-7-pyridin-4-ylpyrido[2,3-d]pyrimidin-2-yl)morpholine is sourced from PubChem (CID 46882230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).