6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide

C13H18N2O4 — CID 91793620

IUPAC6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide
SMILESCOc1ccc(C(=O)N[C@@H]2CCOC[C@H]2OC)cn1
InChIInChI=1S/C13H18N2O4/c1-17-11-8-19-6-5-10(11)15-13(16)9-3-4-12(18-2)14-7-9/h3-4,7,10-11H,5-6,8H2,1-2H3,(H,15,16)/t10-,11-/m1/s1
InChIKeyDZBCWIZLALESRI-GHMZBOCLSA-N
MW266.30 g/mol
LogP0.62
Rot. Bonds4

About 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide

6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide (PubChem CID 91793620) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide
PubChem CID91793620
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide
SMILESCOc1ccc(C(=O)N[C@@H]2CCOC[C@H]2OC)cn1
InChIInChI=1S/C13H18N2O4/c1-17-11-8-19-6-5-10(11)15-13(16)9-3-4-12(18-2)14-7-9/h3-4,7,10-11H,5-6,8H2,1-2H3,(H,15,16)/t10-,11-/m1/s1
InChIKeyDZBCWIZLALESRI-GHMZBOCLSA-N
XLogP0.62
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-N-[5-[[(3R,4R)-4-methoxyoxan-3-yl]carbamoyl]-2-methylphenyl]pyridine-3-carboxamide
CID 172668266
6-cyano-N-[(3R,4R)-4-methoxyoxan-3-yl]pyridine-3-carboxamide
CID 91831669
(6-methoxy-3-pyridinyl)-(oxolan-3-yl)methanone
CID 130594889
N-[(3S,4R)-3-(4-carbamoylphenoxy)oxan-4-yl]-2-methylpyrimidine-5-carboxamide
CID 91770875
N-[(3S,4R)-3-methoxyoxan-4-yl]-4-(4-propylphenyl)benzamide
CID 91762361
4-(2-hydroxyethylsulfanyl)-N-[(3S,4R)-3-methoxyoxan-4-yl]benzamide
CID 91762413
N-[2-(hydroxymethyl)cyclopentyl]-6-methoxypyridine-3-carboxamide
CID 113259274
3-chloro-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-4-carboxamide
CID 91781029
4-[(3S,4R)-4-[(2-ethylpyrimidine-5-carbonyl)amino]oxan-3-yl]oxybenzoic acid
CID 91791344
2-cyano-N-[(3S,4R)-3-methoxyoxan-4-yl]benzamide
CID 91770020
N-[(3S,4R)-3-(4-carbamoylphenoxy)oxan-4-yl]pyridazine-4-carboxamide
CID 91788390
2-[(6-methoxypyridine-3-carbonyl)amino]-2-(oxan-3-yl)acetic acid
CID 120547837

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide?
The IUPAC name of 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide (CID 91793620) is 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide?
The canonical SMILES for 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide is COc1ccc(C(=O)N[C@@H]2CCOC[C@H]2OC)cn1.
What is the InChIKey of 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide?
The InChIKey is DZBCWIZLALESRI-GHMZBOCLSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-17-11-8-19-6-5-10(11)15-13(16)9-3-4-12(18-2)14-7-9/h3-4,7,10-11H,5-6,8H2,1-2H3,(H,15,16)/t10-,11-/m1/s1.
What are the key properties of 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide?
6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[(3S,4R)-3-methoxyoxan-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 91793620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).