5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide

C20H18ClN3O2 — CID 55951557

IUPAC5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide
SMILESCC(C)Oc1ncc(C(=O)Nc2ccc(-c3ccccc3)cn2)cc1Cl
InChIInChI=1S/C20H18ClN3O2/c1-13(2)26-20-17(21)10-16(12-23-20)19(25)24-18-9-8-15(11-22-18)14-6-4-3-5-7-14/h3-13H,1-2H3,(H,22,24,25)
InChIKeyXDAXPDPZPLETSR-UHFFFAOYSA-N
MW367.84 g/mol
LogP4.84
Rot. Bonds5

About 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide

5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide (PubChem CID 55951557) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide
PubChem CID55951557
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide
SMILESCC(C)Oc1ncc(C(=O)Nc2ccc(-c3ccccc3)cn2)cc1Cl
InChIInChI=1S/C20H18ClN3O2/c1-13(2)26-20-17(21)10-16(12-23-20)19(25)24-18-9-8-15(11-22-18)14-6-4-3-5-7-14/h3-13H,1-2H3,(H,22,24,25)
InChIKeyXDAXPDPZPLETSR-UHFFFAOYSA-N
XLogP4.84
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.84
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-phenyl-2-pyridinyl)-4-propan-2-yloxybenzamide
CID 24949251
N-[5-(3,4-dichlorophenyl)-2-pyridinyl]benzamide
CID 24949712
5-chloro-N-[2-(3-phenyl-1H-1,2,4-triazol-5-yl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide
CID 55990155
N-(1,3-benzothiazol-2-yl)-5-chloro-6-propan-2-yloxypyridine-3-carboxamide
CID 52687935
5-chloro-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-3-carboxamide
CID 47293511
3-chloro-N-(5-chloro-2-pyridinyl)-5-methoxy-4-propan-2-yloxybenzamide
CID 34135778
(5-phenyl-2-pyridinyl)carbamic acid
CID 69225879
5-chloro-N-(3-hydroxypropyl)-6-propan-2-yloxypyridine-3-carboxamide
CID 78904618
N-(5-chloro-2-pyridinyl)-4-methyl-3-(4-phenylphenyl)benzamide
CID 90885243
N-(5-chloro-2-pyridinyl)-4-propan-2-yloxybenzamide
CID 33327699
6-[(3,4-dichlorobenzoyl)amino]pyridine-3-carboxylic acid
CID 61317958
N-[5-(2-chloro-5-propan-2-yloxyphenyl)-2-pyridinyl]-4-methylpyridine-3-carboxamide
CID 71010092

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide (CID 55951557) is 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide is CC(C)Oc1ncc(C(=O)Nc2ccc(-c3ccccc3)cn2)cc1Cl.
What is the InChIKey of 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide?
The InChIKey is XDAXPDPZPLETSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-13(2)26-20-17(21)10-16(12-23-20)19(25)24-18-9-8-15(11-22-18)14-6-4-3-5-7-14/h3-13H,1-2H3,(H,22,24,25).
What are the key properties of 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide?
5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide has a molecular weight of 367.84 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(5-phenyl-2-pyridinyl)-6-propan-2-yloxypyridine-3-carboxamide is sourced from PubChem (CID 55951557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).