5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide

C17H16Cl2N2O3 — CID 124891774

IUPAC5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide
SMILESO=C(NCc1ccccc1Cl)c1cnc(O[C@@H]2CCOC2)c(Cl)c1
InChIInChI=1S/C17H16Cl2N2O3/c18-14-4-2-1-3-11(14)8-20-16(22)12-7-15(19)17(21-9-12)24-13-5-6-23-10-13/h1-4,7,9,13H,5-6,8,10H2,(H,20,22)/t13-/m1/s1
InChIKeyGNLRAESQLHIAAH-CYBMUJFWSA-N
MW367.23 g/mol
LogP3.49
Rot. Bonds5

About 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide

5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide (PubChem CID 124891774) has the molecular formula C17H16Cl2N2O3 and a molecular weight of 367.23 g/mol. Its IUPAC name is 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide
PubChem CID124891774
Molecular FormulaC17H16Cl2N2O3
Molecular Weight367.23 g/mol
Exact Mass366.05
IUPAC Name5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide
SMILESO=C(NCc1ccccc1Cl)c1cnc(O[C@@H]2CCOC2)c(Cl)c1
InChIInChI=1S/C17H16Cl2N2O3/c18-14-4-2-1-3-11(14)8-20-16(22)12-7-15(19)17(21-9-12)24-13-5-6-23-10-13/h1-4,7,9,13H,5-6,8,10H2,(H,20,22)/t13-/m1/s1
InChIKeyGNLRAESQLHIAAH-CYBMUJFWSA-N
XLogP3.49
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.23
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-6-[(3S)-oxolan-3-yl]oxy-N-[2-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 124875222
5-chloro-N-(6-methoxy-3-pyridinyl)-6-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide
CID 124725428
5-chloro-6-[(3S)-oxolan-3-yl]oxy-N-[4-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide
CID 124873717
N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide
CID 100731047
N-(furan-2-ylmethyl)-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide
CID 100730113
5-chloro-N-[(2-fluorophenyl)methyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 55739738
5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide
CID 138996664
2-[2-(oxolan-3-yloxy)phenyl]acetic acid
CID 80741380
N-(3,3-diphenylpropyl)-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide
CID 100730209
N-[(2-chlorophenyl)methyl]-4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzamide
CID 30920617
N-[(2-chlorophenyl)methyl]-3-ethoxybenzamide
CID 2971835
N-[(2-chlorophenyl)methyl]-6-[(1,1-dioxothiolan-3-yl)amino]pyridine-3-carboxamide
CID 109156849

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide (CID 124891774) is 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide is O=C(NCc1ccccc1Cl)c1cnc(O[C@@H]2CCOC2)c(Cl)c1.
What is the InChIKey of 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide?
The InChIKey is GNLRAESQLHIAAH-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H16Cl2N2O3/c18-14-4-2-1-3-11(14)8-20-16(22)12-7-15(19)17(21-9-12)24-13-5-6-23-10-13/h1-4,7,9,13H,5-6,8,10H2,(H,20,22)/t13-/m1/s1.
What are the key properties of 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide?
5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide has a molecular weight of 367.23 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide is sourced from PubChem (CID 124891774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).