(2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide

C16H17F2N3O3S — CID 134396540

IUPAC(2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide
SMILESCc1ncc(-c2cc(C(N)=O)nc3c2CC[C@H](CCOC(F)F)O3)s1
InChIInChI=1S/C16H17F2N3O3S/c1-8-20-7-13(25-8)11-6-12(14(19)22)21-15-10(11)3-2-9(24-15)4-5-23-16(17)18/h6-7,9,16H,2-5H2,1H3,(H2,19,22)/t9-/m1/s1
InChIKeyARJNHZIYXBCXSD-SECBINFHSA-N
MW369.39 g/mol
LogP2.94
Rot. Bonds6

About (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide

(2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide (PubChem CID 134396540) has the molecular formula C16H17F2N3O3S and a molecular weight of 369.39 g/mol. Its IUPAC name is (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide.

Molecular Properties

Compound Name(2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide
PubChem CID134396540
Molecular FormulaC16H17F2N3O3S
Molecular Weight369.39 g/mol
Exact Mass369.10
IUPAC Name(2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide
SMILESCc1ncc(-c2cc(C(N)=O)nc3c2CC[C@H](CCOC(F)F)O3)s1
InChIInChI=1S/C16H17F2N3O3S/c1-8-20-7-13(25-8)11-6-12(14(19)22)21-15-10(11)3-2-9(24-15)4-5-23-16(17)18/h6-7,9,16H,2-5H2,1H3,(H2,19,22)/t9-/m1/s1
InChIKeyARJNHZIYXBCXSD-SECBINFHSA-N
XLogP2.94
TPSA87.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.39
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carboxylic acid [1-methyl-1-(5-methyl-thiazol-2-yl)-ethyl]-amide
CID 71093531
5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carboxylic acid (1-methyl-1-thiazol-2-yl-ethyl)-amide
CID 71093543
5-Cyclopropyl-6-(2,2,2-trifluoro-ethoxy)-pyridine-2-carboxylic acid (1-methyl-1-thiazol-2-yl-ethyl)-amide
CID 71093567
5-Cyclopentyl-6-cyclopropylmethoxy-pyridine-2-carboxylic acid (1-methyl-1-thiazol-2-yl-ethyl)-amide
CID 71093603
6-Cyclopropylmethoxy-5-(tetrahydro-pyran-4-yl)-pyridine-2-carboxylic acid (1-methyl-1-thiazol-2-yl-ethyl)-amide
CID 71105555
6-Cyclopropylmethoxy-5-(tetrahydro-pyran-4-yl)-pyridine-2-carboxylic acid ((S)-2-cyclopropyl-1-thiazol-2-yl-ethyl)-amide
CID 71105570
5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carboxylic acid ((S)-2-cyclopropyl-1-thiazol-2-yl-ethyl)-amide
CID 71105591
6-Cyclopropylmethoxy-5-trifluoromethyl-pyridine-2-carboxylic acid (1-methyl-1-thiazol-2-yl-ethyl)-amide
CID 71105605
5-Cyclopropyl-6-(2,2,2-trifluoro-ethoxy)-pyridine-2-carboxylic acid (3-thiazol-2-yl-oxetan-3-yl)-amide
CID 71113181
5-cyclopropyl-N-[2,2-dimethyl-1-(1,3-thiazol-2-yl)propyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
CID 71114290
5-cyclopropyl-N-[1-cyclopropyl-2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]-4-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
CID 90204391
5-cyclopropyl-N-[4-(4-methyl-1,3-thiazol-2-yl)oxan-4-yl]-4-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
CID 90204776

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide?
The IUPAC name of (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide (CID 134396540) is (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide.
What is the SMILES notation for (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide?
The canonical SMILES for (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide is Cc1ncc(-c2cc(C(N)=O)nc3c2CC[C@H](CCOC(F)F)O3)s1.
What is the InChIKey of (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide?
The InChIKey is ARJNHZIYXBCXSD-SECBINFHSA-N. The full InChI is InChI=1S/C16H17F2N3O3S/c1-8-20-7-13(25-8)11-6-12(14(19)22)21-15-10(11)3-2-9(24-15)4-5-23-16(17)18/h6-7,9,16H,2-5H2,1H3,(H2,19,22)/t9-/m1/s1.
What are the key properties of (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide?
(2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide has a molecular weight of 369.39 g/mol, XLogP of 2.94, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-(difluoromethoxy)ethyl]-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide is sourced from PubChem (CID 134396540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).