6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile

C22H26N6O — CID 165380851

IUPAC6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile
SMILESCC[C@@H](C)c1nc(Nc2cc3c(C(C)(C)N)cnc(OC)c3cn2)ccc1C#N
InChIInChI=1S/C22H26N6O/c1-6-13(2)20-14(10-23)7-8-18(28-20)27-19-9-15-16(11-25-19)21(29-5)26-12-17(15)22(3,4)24/h7-9,11-13H,6,24H2,1-5H3,(H,25,27,28)/t13-/m1/s1
InChIKeyONOLPXFZARTMOY-CYBMUJFWSA-N
MW390.49 g/mol
LogP4.36
Rot. Bonds6

About 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile

6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile (PubChem CID 165380851) has the molecular formula C22H26N6O and a molecular weight of 390.49 g/mol. Its IUPAC name is 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile
PubChem CID165380851
Molecular FormulaC22H26N6O
Molecular Weight390.49 g/mol
Exact Mass390.22
IUPAC Name6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile
SMILESCC[C@@H](C)c1nc(Nc2cc3c(C(C)(C)N)cnc(OC)c3cn2)ccc1C#N
InChIInChI=1S/C22H26N6O/c1-6-13(2)20-14(10-23)7-8-18(28-20)27-19-9-15-16(11-25-19)21(29-5)26-12-17(15)22(3,4)24/h7-9,11-13H,6,24H2,1-5H3,(H,25,27,28)/t13-/m1/s1
InChIKeyONOLPXFZARTMOY-CYBMUJFWSA-N
XLogP4.36
TPSA109.74 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile with MolForge

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Related Compounds

4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328061
5-Amino-7-benzyl-2-methoxy-6,7,8,9-tetrahydropyrido[2,3-b][1,6]naphthyridine-3-carbonitrile
CID 53326509
N1-(7-(4-methoxyphenyl)-1,6-naphthyridin-5-yl)propane-1,3-diamine
CID 10149633
N1-(7-(3-methoxyphenyl)-1,6-naphthyridin-5-yl)propane-1,3-diamine
CID 10236578
7-(4-Methoxyphenyl)-n-methyl-1,6-naphthyridin-5-amine
CID 44280099
N-(3-methoxyphenyl)-2-pyridin-4-ylquinazolin-4-amine
CID 71296003
6-(6-Methoxy-3-pyridinyl)-4-methylpyrido[2,3-d]pyrimidin-2-amine
CID 118321355
5-(2-aminopropan-2-yl)-N-[2-(2-fluoropropan-2-yl)pyrimidin-4-yl]-8-methoxy-2,7-naphthyridin-3-amine
CID 165381136
6-[[5-(2-Aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-(2-fluoropropan-2-yl)pyridine-3-carbonitrile
CID 165381237
N-(3-methoxyphenyl)-2-(pyridin-3-yl)quinazolin-4-amine
CID 787509
3-[[2-(3-Methoxyanilino)-6-pyridin-4-ylpyrimidin-4-yl]amino]benzonitrile
CID 44525736
6-(5-Fluoro-6-methoxy-3-pyridinyl)-4-methylpyrido[2,3-d]pyrimidin-2-amine
CID 118712087

Frequently Asked Questions

What is the IUPAC name of 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile?
The IUPAC name of 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile (CID 165380851) is 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile?
The canonical SMILES for 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile is CC[C@@H](C)c1nc(Nc2cc3c(C(C)(C)N)cnc(OC)c3cn2)ccc1C#N.
What is the InChIKey of 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile?
The InChIKey is ONOLPXFZARTMOY-CYBMUJFWSA-N. The full InChI is InChI=1S/C22H26N6O/c1-6-13(2)20-14(10-23)7-8-18(28-20)27-19-9-15-16(11-25-19)21(29-5)26-12-17(15)22(3,4)24/h7-9,11-13H,6,24H2,1-5H3,(H,25,27,28)/t13-/m1/s1.
What are the key properties of 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile?
6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile has a molecular weight of 390.49 g/mol, XLogP of 4.36, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[5-(2-aminopropan-2-yl)-8-methoxy-2,7-naphthyridin-3-yl]amino]-2-[(2R)-butan-2-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 165380851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).