6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide

C24H25N5O2 — CID 67341196

IUPAC6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)NC23CC4CC(C2)CC(c2nc(-c5cccnc5)no2)(C4)C3)n1
InChIInChI=1S/C24H25N5O2/c1-15-4-2-6-19(26-15)21(30)28-24-11-16-8-17(12-24)10-23(9-16,14-24)22-27-20(29-31-22)18-5-3-7-25-13-18/h2-7,13,16-17H,8-12,14H2,1H3,(H,28,30)
InChIKeyKQQCONIGLTUDFJ-UHFFFAOYSA-N
MW415.50 g/mol
LogP3.86
Rot. Bonds4

About 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide

6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide (PubChem CID 67341196) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide
PubChem CID67341196
Molecular FormulaC24H25N5O2
Molecular Weight415.50 g/mol
Exact Mass415.20
IUPAC Name6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)NC23CC4CC(C2)CC(c2nc(-c5cccnc5)no2)(C4)C3)n1
InChIInChI=1S/C24H25N5O2/c1-15-4-2-6-19(26-15)21(30)28-24-11-16-8-17(12-24)10-23(9-16,14-24)22-27-20(29-31-22)18-5-3-7-25-13-18/h2-7,13,16-17H,8-12,14H2,1H3,(H,28,30)
InChIKeyKQQCONIGLTUDFJ-UHFFFAOYSA-N
XLogP3.86
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide with MolForge

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Related Compounds

2-methyl-N-[3-[3-(6-methyl-3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-adamantyl]pyrimidine-4-carboxamide
CID 53327488
N-[3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-1-adamantyl]-6-methylpyridine-2-carboxamide
CID 67323563
N-[3-[(3-cyanobenzoyl)amino]-1-adamantyl]-6-methylpyridine-2-carboxamide
CID 44633442
6-methyl-N-[3-(oxan-4-ylmethylamino)-1-adamantyl]pyridine-2-carboxamide
CID 123657933
N-[7-methyl-5-[3-(6-methyl-3-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-tricyclo[3.3.1.01,3]nonanyl]pyrazine-2-carboxamide
CID 123523886
N-[3-(6-fluoro-1H-benzimidazol-2-yl)-1-adamantyl]-6-methylpyridine-2-carboxamide
CID 53327244
[3-[(6-methylpyridine-2-carbonyl)amino]-1-adamantyl] azetidine-1-carboxylate
CID 53327442
2-(2-methoxyethoxy)ethyl N-[3-[(6-methylpyridine-2-carbonyl)amino]-1-adamantyl]carbamate
CID 67323372
N-[3-[2-(6-fluoro-2-pyridinyl)-2-oxoethyl]-1-adamantyl]-6-methylpyridine-2-carboxamide
CID 58358675
2,2,2-trifluoroethyl N-[3-[(6-methylpyridine-2-carbonyl)amino]-1-adamantyl]carbamate
CID 67323386
N-[3-[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]-1-adamantyl]pyrimidine-4-carboxamide
CID 67375901
N-(3-amino-1-adamantyl)-6-methylpyridine-2-carboxamide;6-(trifluoromethyl)pyridine-2-carboxylic acid
CID 162621415

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide (CID 67341196) is 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide is Cc1cccc(C(=O)NC23CC4CC(C2)CC(c2nc(-c5cccnc5)no2)(C4)C3)n1.
What is the InChIKey of 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide?
The InChIKey is KQQCONIGLTUDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c1-15-4-2-6-19(26-15)21(30)28-24-11-16-8-17(12-24)10-23(9-16,14-24)22-27-20(29-31-22)18-5-3-7-25-13-18/h2-7,13,16-17H,8-12,14H2,1H3,(H,28,30).
What are the key properties of 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide?
6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide has a molecular weight of 415.50 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1-adamantyl]pyridine-2-carboxamide is sourced from PubChem (CID 67341196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).