methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate

C24H25N3O5 — CID 67765270

IUPACmethyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate
SMILESCOC(=O)c1ccc(NC(=O)c2cc(OC(C)C)nc(O[C@H](C)c3ccccc3)c2)nc1
InChIInChI=1S/C24H25N3O5/c1-15(2)31-21-12-19(13-22(27-21)32-16(3)17-8-6-5-7-9-17)23(28)26-20-11-10-18(14-25-20)24(29)30-4/h5-16H,1-4H3,(H,25,26,28)/t16-/m1/s1
InChIKeyFXYSJMJDZVSTKA-MRXNPFEDSA-N
MW435.48 g/mol
LogP4.44
Rot. Bonds8

About methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate

methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate (PubChem CID 67765270) has the molecular formula C24H25N3O5 and a molecular weight of 435.48 g/mol. Its IUPAC name is methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate
PubChem CID67765270
Molecular FormulaC24H25N3O5
Molecular Weight435.48 g/mol
Exact Mass435.18
IUPAC Namemethyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate
SMILESCOC(=O)c1ccc(NC(=O)c2cc(OC(C)C)nc(O[C@H](C)c3ccccc3)c2)nc1
InChIInChI=1S/C24H25N3O5/c1-15(2)31-21-12-19(13-22(27-21)32-16(3)17-8-6-5-7-9-17)23(28)26-20-11-10-18(14-25-20)24(29)30-4/h5-16H,1-4H3,(H,25,26,28)/t16-/m1/s1
InChIKeyFXYSJMJDZVSTKA-MRXNPFEDSA-N
XLogP4.44
TPSA99.64 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.48
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate with MolForge

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Launch Full Analysis

Related Compounds

6-[(2-pentan-3-yloxy-6-propan-2-yloxypyridine-4-carbonyl)amino]pyridine-3-carboxylic acid
CID 143828094
methyl 6-[[2-(4-benzamidophenoxy)-6-[(2R)-1-methoxypropan-2-yl]oxypyridine-4-carbonyl]amino]pyridine-3-carboxylate
CID 143828089
6-[[2-(4-methoxyphenoxy)-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylic acid
CID 67489827
ethane;methyl 6-benzamidopyridine-3-carboxylate
CID 91195390
6-[(2-methylsulfonyloxy-6-propan-2-yloxypyridine-4-carbonyl)amino]pyridine-3-carboxylic acid
CID 87419927
6-[[2-[(2S)-1-hydroxypropan-2-yl]oxy-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylic acid
CID 67765328
2-(2-methylpropoxy)-6-propan-2-yloxy-N-(5-prop-1-en-2-yl-2-pyridinyl)pyridine-4-carboxamide
CID 143828066
methyl 6-[[3-hydroxy-5-[(2S)-1-methoxypropan-2-yl]oxybenzoyl]amino]pyridine-3-carboxylate
CID 58852339
6-[[2,6-di(propan-2-yloxy)pyrimidine-4-carbonyl]amino]pyridine-3-carboxylic acid
CID 71496573
6-[[2-propan-2-yloxy-6-[[4-(trifluoromethyl)phenyl]methoxy]pyridine-4-carbonyl]amino]pyridine-3-carboxylic acid
CID 143828092
methyl 6-[(2-methylbenzoyl)amino]pyridine-3-carboxylate
CID 54003775
methyl 6-[[5-(2-fluorophenyl)sulfanyl-2-methyl-3-propan-2-yloxybenzoyl]amino]pyridine-3-carboxylate
CID 69434154

Frequently Asked Questions

What is the IUPAC name of methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate?
The IUPAC name of methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate (CID 67765270) is methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate.
What is the SMILES notation for methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate?
The canonical SMILES for methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate is COC(=O)c1ccc(NC(=O)c2cc(OC(C)C)nc(O[C@H](C)c3ccccc3)c2)nc1.
What is the InChIKey of methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate?
The InChIKey is FXYSJMJDZVSTKA-MRXNPFEDSA-N. The full InChI is InChI=1S/C24H25N3O5/c1-15(2)31-21-12-19(13-22(27-21)32-16(3)17-8-6-5-7-9-17)23(28)26-20-11-10-18(14-25-20)24(29)30-4/h5-16H,1-4H3,(H,25,26,28)/t16-/m1/s1.
What are the key properties of methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate?
methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate has a molecular weight of 435.48 g/mol, XLogP of 4.44, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-[[2-[(1R)-1-phenylethoxy]-6-propan-2-yloxypyridine-4-carbonyl]amino]pyridine-3-carboxylate is sourced from PubChem (CID 67765270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).