2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide

C17H17N5O2 — CID 110615826

IUPAC2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)NCc1nnc(-c2ccccc2)o1
InChIInChI=1S/C17H17N5O2/c1-22(2)15-13(9-6-10-18-15)16(23)19-11-14-20-21-17(24-14)12-7-4-3-5-8-12/h3-10H,11H2,1-2H3,(H,19,23)
InChIKeyDUYQJFAFRFCLOL-UHFFFAOYSA-N
MW323.36 g/mol
LogP2.13
Rot. Bonds5

About 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide

2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 110615826) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide
PubChem CID110615826
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC Name2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)NCc1nnc(-c2ccccc2)o1
InChIInChI=1S/C17H17N5O2/c1-22(2)15-13(9-6-10-18-15)16(23)19-11-14-20-21-17(24-14)12-7-4-3-5-8-12/h3-10H,11H2,1-2H3,(H,19,23)
InChIKeyDUYQJFAFRFCLOL-UHFFFAOYSA-N
XLogP2.13
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 110299234
2-fluoro-N-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 110318527
N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-2-methoxybenzamide
CID 110319111
2-chloro-N-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]benzamide
CID 110319423
2-bromo-N-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]benzamide
CID 110319392
2-(dimethylamino)-N-phenylpyridine-3-carboxamide
CID 38885522
2-(5-phenyl-1,3,4-oxadiazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 50848243
2-(dimethylamino)-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 110475162
4-(2-methylphenyl)-4-oxo-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]butanamide
CID 110606895
1-phenyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]urea
CID 110318453
2-(2-methoxyphenoxy)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 110318462
N-ethyl-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acetamide
CID 46249412

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide (CID 110615826) is 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide is CN(C)c1ncccc1C(=O)NCc1nnc(-c2ccccc2)o1.
What is the InChIKey of 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is DUYQJFAFRFCLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c1-22(2)15-13(9-6-10-18-15)16(23)19-11-14-20-21-17(24-14)12-7-4-3-5-8-12/h3-10H,11H2,1-2H3,(H,19,23).
What are the key properties of 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide?
2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 323.36 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 110615826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).